[日本語] English
万見
- PDB-8bbn: SARS-CoV-2 Delta-RBD complexed with BA.2-10 and EY6A Fabs -

+
データを開く


IDまたはキーワード:

読み込み中...

-
基本情報

登録情報
データベース: PDB / ID: 8bbn
タイトルSARS-CoV-2 Delta-RBD complexed with BA.2-10 and EY6A Fabs
要素
  • BA.2-10 heavy chain
  • BA.2-10 light chain
  • EY6A Heavy chain
  • EY6A light chain
  • Spike protein S1
キーワードVIRAL PROTEIN / SARS-CoV-2 / BA.2 mAb / RBD / BA.2-36 / BA.2-10
機能・相同性
機能・相同性情報


Maturation of spike protein / viral translation / Translation of Structural Proteins / Virion Assembly and Release / host cell surface / host extracellular space / symbiont-mediated-mediated suppression of host tetherin activity / Induction of Cell-Cell Fusion / structural constituent of virion / entry receptor-mediated virion attachment to host cell ...Maturation of spike protein / viral translation / Translation of Structural Proteins / Virion Assembly and Release / host cell surface / host extracellular space / symbiont-mediated-mediated suppression of host tetherin activity / Induction of Cell-Cell Fusion / structural constituent of virion / entry receptor-mediated virion attachment to host cell / membrane fusion / Attachment and Entry / host cell endoplasmic reticulum-Golgi intermediate compartment membrane / positive regulation of viral entry into host cell / receptor-mediated virion attachment to host cell / host cell surface receptor binding / symbiont-mediated suppression of host innate immune response / receptor ligand activity / endocytosis involved in viral entry into host cell / fusion of virus membrane with host plasma membrane / fusion of virus membrane with host endosome membrane / viral envelope / virion attachment to host cell / SARS-CoV-2 activates/modulates innate and adaptive immune responses / host cell plasma membrane / virion membrane / identical protein binding / membrane / plasma membrane
類似検索 - 分子機能
Spike (S) protein S1 subunit, receptor-binding domain, SARS-CoV-2 / Spike (S) protein S1 subunit, N-terminal domain, SARS-CoV-like / Coronavirus spike glycoprotein S1, C-terminal / Coronavirus spike glycoprotein S1, C-terminal / Spike glycoprotein, betacoronavirus / Spike glycoprotein, N-terminal domain superfamily / Betacoronavirus spike (S) glycoprotein S1 subunit N-terminal (NTD) domain profile. / Betacoronavirus spike (S) glycoprotein S1 subunit C-terminal (CTD) domain profile. / Spike (S) protein S1 subunit, receptor-binding domain, betacoronavirus / Spike S1 subunit, receptor binding domain superfamily, betacoronavirus ...Spike (S) protein S1 subunit, receptor-binding domain, SARS-CoV-2 / Spike (S) protein S1 subunit, N-terminal domain, SARS-CoV-like / Coronavirus spike glycoprotein S1, C-terminal / Coronavirus spike glycoprotein S1, C-terminal / Spike glycoprotein, betacoronavirus / Spike glycoprotein, N-terminal domain superfamily / Betacoronavirus spike (S) glycoprotein S1 subunit N-terminal (NTD) domain profile. / Betacoronavirus spike (S) glycoprotein S1 subunit C-terminal (CTD) domain profile. / Spike (S) protein S1 subunit, receptor-binding domain, betacoronavirus / Spike S1 subunit, receptor binding domain superfamily, betacoronavirus / Betacoronavirus spike glycoprotein S1, receptor binding / Spike glycoprotein S1, N-terminal domain, betacoronavirus-like / Betacoronavirus-like spike glycoprotein S1, N-terminal / Spike glycoprotein S2, coronavirus, heptad repeat 1 / Spike glycoprotein S2, coronavirus, heptad repeat 2 / Coronavirus spike (S) glycoprotein S2 subunit heptad repeat 1 (HR1) region profile. / Coronavirus spike (S) glycoprotein S2 subunit heptad repeat 2 (HR2) region profile. / Spike glycoprotein S2 superfamily, coronavirus / Spike glycoprotein S2, coronavirus / Coronavirus spike glycoprotein S2 / Immunoglobulins / Immunoglobulin-like / Sandwich / Mainly Beta
類似検索 - ドメイン・相同性
Spike glycoprotein
類似検索 - 構成要素
生物種Homo sapiens (ヒト)
Severe acute respiratory syndrome coronavirus 2 (ウイルス)
手法X線回折 / シンクロトロン / 分子置換 / 解像度: 3.58 Å
データ登録者Zhou, D. / Ren, J. / Stuart, D.I.
資金援助 英国, 2件
組織認可番号国
CAMS Innovation Fund for Medical Sciences (CIFMS)2018-I2M-2-002 英国
Medical Research Council (MRC, United Kingdom)MR/N00065X/1 英国
引用ジャーナル: Cell Rep / 年: 2023
タイトル: Rapid escape of new SARS-CoV-2 Omicron variants from BA.2-directed antibody responses.
著者: Aiste Dijokaite-Guraliuc / Raksha Das / Daming Zhou / Helen M Ginn / Chang Liu / Helen M E Duyvesteyn / Jiandong Huo / Rungtiwa Nutalai / Piyada Supasa / Muneeswaran Selvaraj / Thushan I de ...著者: Aiste Dijokaite-Guraliuc / Raksha Das / Daming Zhou / Helen M Ginn / Chang Liu / Helen M E Duyvesteyn / Jiandong Huo / Rungtiwa Nutalai / Piyada Supasa / Muneeswaran Selvaraj / Thushan I de Silva / Megan Plowright / Thomas A H Newman / Hailey Hornsby / Alexander J Mentzer / Donal Skelly / Thomas G Ritter / Nigel Temperton / Paul Klenerman / Eleanor Barnes / Susanna J Dunachie / / Cornelius Roemer / Thomas P Peacock / Neil G Paterson / Mark A Williams / David R Hall / Elizabeth E Fry / Juthathip Mongkolsapaya / Jingshan Ren / David I Stuart / Gavin R Screaton /
要旨: In November 2021, Omicron BA.1, containing a raft of new spike mutations, emerged and quickly spread globally. Intense selection pressure to escape the antibody response produced by vaccines or ...In November 2021, Omicron BA.1, containing a raft of new spike mutations, emerged and quickly spread globally. Intense selection pressure to escape the antibody response produced by vaccines or severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) infection then led to a rapid succession of Omicron sub-lineages with waves of BA.2 and then BA.4/5 infection. Recently, many variants have emerged such as BQ.1 and XBB, which carry up to 8 additional receptor-binding domain (RBD) amino acid substitutions compared with BA.2. We describe a panel of 25 potent monoclonal antibodies (mAbs) generated from vaccinees suffering BA.2 breakthrough infections. Epitope mapping shows potent mAb binding shifting to 3 clusters, 2 corresponding to early-pandemic binding hotspots. The RBD mutations in recent variants map close to these binding sites and knock out or severely knock down neutralization activity of all but 1 potent mAb. This recent mAb escape corresponds with large falls in neutralization titer of vaccine or BA.1, BA.2, or BA.4/5 immune serum.
履歴
登録2022年10月14日登録サイト: PDBE / 処理サイト: PDBE
改定 1.02023年3月22日Provider: repository / タイプ: Initial release
改定 1.12023年4月12日Group: Database references / カテゴリ: citation / citation_author
Item: _citation.journal_volume / _citation.page_first ..._citation.journal_volume / _citation.page_first / _citation.page_last / _citation.pdbx_database_id_PubMed / _citation.title / _citation_author.name
改定 1.22024年2月7日Group: Data collection / Refinement description
カテゴリ: chem_comp_atom / chem_comp_bond / pdbx_initial_refinement_model
改定 1.32024年11月13日Group: Structure summary
カテゴリ: pdbx_entry_details / pdbx_modification_feature

-
構造の表示

構造ビューア分子:
MolmilJmol/JSmol

ダウンロードとリンク

-
集合体

登録構造単位
M: EY6A Heavy chain
N: EY6A light chain
J: EY6A Heavy chain
K: EY6A light chain
E: EY6A Heavy chain
F: EY6A light chain
R: Spike protein S1
L: BA.2-10 light chain
H: BA.2-10 heavy chain
Y: Spike protein S1
D: BA.2-10 light chain
C: BA.2-10 heavy chain
X: Spike protein S1
B: BA.2-10 light chain
A: BA.2-10 heavy chain


分子量 (理論値)分子数
合計 (水以外)356,01115
ポリマ－356,01115
非ポリマー00
水00
1
M: EY6A Heavy chain
N: EY6A light chain
Y: Spike protein S1
D: BA.2-10 light chain
C: BA.2-10 heavy chain


分子量 (理論値)分子数
合計 (水以外)118,6705
ポリマ－118,6705
非ポリマー00
水0
タイプ名称対称操作数
identity operation1_555x,y,z1
2
J: EY6A Heavy chain
K: EY6A light chain
X: Spike protein S1
B: BA.2-10 light chain
A: BA.2-10 heavy chain


分子量 (理論値)分子数
合計 (水以外)118,6705
ポリマ－118,6705
非ポリマー00
水0
タイプ名称対称操作数
identity operation1_555x,y,z1
3
E: EY6A Heavy chain
F: EY6A light chain
R: Spike protein S1
L: BA.2-10 light chain
H: BA.2-10 heavy chain


分子量 (理論値)分子数
合計 (水以外)118,6705
ポリマ－118,6705
非ポリマー00
水0
タイプ名称対称操作数
identity operation1_555x,y,z1
単位格子
Length a, b, c (Å)170.655, 171.691, 176.991
Angle α, β, γ (deg.)90.000, 90.000, 90.000
Int Tables number19
Space group name H-MP212121
Space group name HallP2ac2ab
Symmetry operation#1: x,y,z
#2: x+1/2,-y+1/2,-z
#3: -x,y+1/2,-z+1/2
#4: -x+1/2,-y,z+1/2
非結晶学的対称性 (NCS)NCSドメイン:
IDEns-ID詳細
d_1ens_1(chain "A" and (resid 2 through 128 or resid 130 through 225 or resid 227 through 228))
d_2ens_1(chain "C" and (resid 2 through 128 or resid 130 through 225 or resid 227 through 228))
d_3ens_1(chain "H" and (resid 2 through 128 or resid 130 through 225 or resid 227 through 228))
d_1ens_2(chain "B" and (resid 2 through 3 or resid 5...
d_2ens_2(chain "D" and (resid 2 through 3 or resid 5...
d_3ens_2(chain "F" and (resid 2 through 3 or resid 5...
d_4ens_2(chain "K" and (resid 2 through 3 or resid 5...
d_5ens_2(chain "L" and (resid 2 through 3 or resid 5...
d_6ens_2(chain "N" and (resid 2 through 3 or resid 5...
d_1ens_3chain "E"
d_2ens_3chain "J"
d_3ens_3chain "M"
d_1ens_4(chain "R" and (resid 334 through 465 or resid 467 through 527))
d_2ens_4(chain "X" and (resid 334 through 465 or resid 467 through 527))
d_3ens_4(chain "Y" and (resid 334 through 465 or resid 467 through 527))

NCSドメイン領域:
Dom-IDComponent-IDEns-IDBeg label comp-IDEnd label comp-IDLabel asym-IDLabel seq-ID
d_11ens_1VALTHRO2 - 128
d_12ens_1GLYPROO130 - 225
d_13ens_1SERCYSO227 - 228
d_21ens_1VALTHRL1 - 127
d_22ens_1GLYPROL130 - 225
d_23ens_1SERCYSL227 - 228
d_31ens_1VALTHRI2 - 128
d_32ens_1GLYPROI130 - 225
d_33ens_1SERCYSI227 - 228
d_11ens_2ILEGLNH2 - 3
d_12ens_2THRVALH5 - 15
d_13ens_2ASPCYSH17 - 23
d_14ens_2ALAILEH25 - 29
d_15ens_2TYRPROH32 - 44
d_16ens_2LEUASPH46 - 82
d_17ens_2ALACYSH84 - 88
d_18ens_2GLNGLNH90
d_19ens_2TYRSERH92 - 93
d_110ens_2THRGLYH97 - 99
d_111ens_2GLYVALH101 - 104
d_112ens_2LYSASPH107 - 122
d_113ens_2GLNSERH124 - 168
d_114ens_2ASPARGH170 - 211
d_21ens_2ILEGLNK2 - 3
d_22ens_2THRVALK5 - 15
d_23ens_2ASPCYSK17 - 23
d_24ens_2ALAILEK25 - 29
d_25ens_2TYRPROK32 - 44
d_26ens_2LEUASPK46 - 82
d_27ens_2ALACYSK84 - 88
d_28ens_2GLNGLNK90
d_29ens_2TYRSERK92 - 93
d_210ens_2THRGLYK97 - 99
d_211ens_2GLYVALK101 - 104
d_212ens_2LYSASPK107 - 122
d_213ens_2GLNSERK124 - 168
d_214ens_2ASPARGK170 - 211
d_31ens_2ILEGLNN2 - 3
d_32ens_2THRVALN5 - 15
d_33ens_2ASPCYSN17 - 23
d_34ens_2ALAILEN25 - 29
d_35ens_2TYRPRON32 - 44
d_36ens_2LEUASPN46 - 82
d_37ens_2ALACYSN84 - 88
d_38ens_2GLNGLNN90
d_39ens_2TYRSERN92 - 93
d_310ens_2THRGLYN97 - 99
d_311ens_2GLYVALN101 - 104
d_312ens_2LYSASPN107 - 122
d_313ens_2GLNSERN124 - 168
d_314ens_2ASPARGN170 - 211
d_41ens_2ILEGLND2 - 3
d_42ens_2THRVALD5 - 15
d_43ens_2ASPCYSD17 - 23
d_44ens_2ALAILED25 - 29
d_45ens_2TYRPROD32 - 44
d_46ens_2LEUASPD46 - 82
d_47ens_2ALACYSD84 - 88
d_48ens_2GLNGLND90
d_49ens_2TYRSERD92 - 93
d_410ens_2THRGLYD98 - 100
d_411ens_2GLYVALD102 - 105
d_412ens_2LYSASPD108 - 123
d_413ens_2GLNSERD125 - 169
d_414ens_2ASPARGD171 - 212
d_51ens_2ILEGLNB2 - 3
d_52ens_2THRVALB5 - 15
d_53ens_2ASPCYSB17 - 23
d_54ens_2ALAILEB25 - 29
d_55ens_2TYRPROB32 - 44
d_56ens_2LEUASPB46 - 82
d_57ens_2ALACYSB84 - 88
d_58ens_2GLNGLNB90
d_59ens_2TYRSERB92 - 93
d_510ens_2THRGLYB98 - 100
d_511ens_2GLYVALB102 - 105
d_512ens_2LYSASPB108 - 123
d_513ens_2GLNSERB125 - 169
d_514ens_2ASPARGB171 - 212
d_61ens_2ILEGLNF2 - 3
d_62ens_2THRVALF5 - 15
d_63ens_2ASPCYSF17 - 23
d_64ens_2ALAILEF25 - 29
d_65ens_2TYRPROF32 - 44
d_66ens_2LEUASPF46 - 82
d_67ens_2ALACYSF84 - 88
d_68ens_2GLNGLNF90
d_69ens_2TYRSERF92 - 93
d_610ens_2THRGLYF98 - 100
d_611ens_2GLYVALF102 - 105
d_612ens_2LYSASPF108 - 123
d_613ens_2GLNSERF125 - 169
d_614ens_2ASPARGF171 - 212
d_11ens_3GLUPROE1 - 221
d_21ens_3GLUPROC1 - 221
d_31ens_3GLUPROA1 - 221
d_11ens_4ASNGLUG8 - 139
d_12ens_4ASPLYSG141 - 201
d_21ens_4ASNGLUM8 - 139
d_22ens_4ASPLYSM141 - 201
d_31ens_4ASNGLUJ8 - 139
d_32ens_4ASPLYSJ141 - 201

NCSアンサンブル:
ID
ens_1
ens_2
ens_3
ens_4

NCS oper:
IDCodeMatrixベクター
1given(-0.351885305428, -0.529239251457, 0.772063822842), (-0.546194125525, -0.553742461742, -0.628523080966), (0.760163606776, -0.642864760881, -0.0942135348643)-72.9889744912, -87.59281854, 4.71076285071
2given(0.623882537037, -0.403077757909, 0.669551268432), (-0.440270687995, 0.526572453164, 0.727243544393), (-0.645702951265, -0.748498345121, 0.151056036224)-73.089592152, 8.62958602084, -27.9325604702
3given(-0.36599728123, -0.52069186296, 0.771314445593), (-0.53928535908, -0.556801901174, -0.631777606703), (0.758430808719, -0.64718747415, -0.0770135162733)-74.6361764796, -86.8438379207, 4.6131273558
4given(-0.207290081392, 0.970945693842, -0.119562877876), (-0.764760799321, -0.0846169620474, 0.638733817451), (0.610058802066, 0.223840187061, 0.76008146187)-89.7414229734, -74.2179444047, 98.392516208
5given(-0.0559123064501, 0.384227819079, -0.921543703268), (-0.793013484804, -0.577881616916, -0.192827512946), (-0.606632860061, 0.720015152532, 0.337008535823)-47.6255223311, -133.576609414, -45.1529175923
6given(0.621432015009, -0.395459503323, 0.676338696183), (-0.450515441749, 0.525895415522, 0.721435962979), (-0.640982127261, -0.753024430656, 0.148647634918)-73.2887628356, 8.0930767113, -27.9367216213
7given(0.0342719250778, 0.619294050937, 0.784410806673), (0.888581170755, -0.378122539429, 0.259705310216), (0.457437359789, 0.688112072013, -0.563252020165)-21.7640477129, 45.0443897421, 55.7898191191
8given(0.49539090703, -0.590133194507, -0.637440712516), (-0.365914381985, 0.523767419054, -0.769268714946), (0.787841680979, 0.614337450819, 0.0435313936413)17.0329837584, -52.0117542184, 66.8426967575
9given(0.496973959309, 0.44345278824, 0.745899797809), (-0.575584563986, -0.474805830383, 0.665779117377), (0.649399178834, -0.760203293887, 0.0192784463392)-19.0678307802, -107.450529778, 55.8149595481
10given(0.515943304761, -0.533887759916, -0.669900265774), (-0.378511834673, 0.559453664805, -0.737387542578), (0.768460342038, 0.634015344253, 0.0865635371647)21.5871544019, -53.870798096, 62.6752200721
11given(0.489825488812, 0.425397779601, 0.76099127434), (-0.582522902079, -0.48973209558, 0.648713760539), (0.64864324483, -0.76105138044, 0.00792068600654)-21.5385702682, -107.597343379, 56.2210287366

-
要素

#1: 抗体 EY6A Heavy chain


分子量: 24346.273 Da / 分子数: 3 / 由来タイプ: 組換発現 / 由来: (組換発現) Homo sapiens (ヒト) / 発現宿主: Homo sapiens (ヒト)
#2: 抗体 EY6A light chain


分子量: 23315.855 Da / 分子数: 3 / 由来タイプ: 組換発現 / 由来: (組換発現) Homo sapiens (ヒト) / 発現宿主: Homo sapiens (ヒト)
#3: タンパク質 Spike protein S1


分子量: 22935.734 Da / 分子数: 3 / 由来タイプ: 組換発現
由来: (組換発現) Severe acute respiratory syndrome coronavirus 2 (ウイルス)
遺伝子: S, 2 / 発現宿主: Homo sapiens (ヒト) / 参照: UniProt: P0DTC2
#4: 抗体 BA.2-10 light chain


分子量: 23441.947 Da / 分子数: 3 / 由来タイプ: 組換発現 / 由来: (組換発現) Homo sapiens (ヒト) / 発現宿主: Homo sapiens (ヒト)
#5: 抗体 BA.2-10 heavy chain


分子量: 24630.637 Da / 分子数: 3 / 由来タイプ: 組換発現 / 由来: (組換発現) Homo sapiens (ヒト) / 発現宿主: Homo sapiens (ヒト)
Has protein modificationY

-
実験情報

-
実験

実験手法: X線回折 / 使用した結晶の数: 1

-
試料調製

結晶マシュー密度: 3.64 Å3/Da / 溶媒含有率: 66.22 %
結晶化温度: 293 K / 手法: 蒸気拡散法, シッティングドロップ法
詳細: 10% (v/v) 2-propanol, 0.1 M BICINE, pH 8.5 and 30% (w/v) PEG 1500

-
データ収集

回折平均測定温度: 100 K / Serial crystal experiment: N
放射光源由来: シンクロトロン / サイト: Diamond / ビームライン: I03 / 波長: 0.97628 Å
検出器タイプ: DECTRIS EIGER2 XE 16M / 検出器: PIXEL / 日付: 2022年10月5日
放射プロトコル: SINGLE WAVELENGTH / 単色(M)・ラウエ(L): M / 散乱光タイプ: x-ray
放射波長波長: 0.97628 Å / 相対比: 1
反射解像度: 3.58→57 Å / Num. obs: 61670 / % possible obs: 100 % / 冗長度: 13.8 % / Biso Wilson estimate: 130.09 Å2 / CC1/2: 0.992 / Rmerge(I) obs: 0.467 / Rpim(I) all: 0.13 / Net I/σ(I): 4.1
反射 シェル解像度: 3.58→3.65 Å / Mean I/σ(I) obs: 0.3 / Num. unique obs: 2966 / CC1/2: 0.301 / % possible all: 97.2

-
解析

ソフトウェア
名称バージョン分類
GDA1.20.1_4487データ収集
PHENIX1.20.1_4487精密化
xia2データ削減
xia2データスケーリング
PHASER位相決定
精密化構造決定の手法: 分子置換
開始モデル: 7NX6

7nx6


解像度: 3.58→55.79 Å / SU ML: 0.6303 / 交差検証法: FREE R-VALUE / σ(F): 1.33 / 位相誤差: 38.3325
立体化学のターゲット値: GeoStd + Monomer Library + CDL v1.2
Rfactor反射数%反射
Rfree0.3139 2840 5.14 %
Rwork0.2654 52453 -
obs0.268 55293 89.63 %
溶媒の処理減衰半径: 0.9 Å / VDWプローブ半径: 1.1 Å / 溶媒モデル: FLAT BULK SOLVENT MODEL
原子変位パラメータBiso mean: 173.83 Å2
精密化ステップサイクル: LAST / 解像度: 3.58→55.79 Å
タンパク質核酸リガンド溶媒全体
原子数24330 0 0 0 24330
拘束条件
Refine-IDタイプDev ideal数
X-RAY DIFFRACTIONf_bond_d0.002224942
X-RAY DIFFRACTIONf_angle_d0.52333930
X-RAY DIFFRACTIONf_chiral_restr0.04263771
X-RAY DIFFRACTIONf_plane_restr0.00444356
X-RAY DIFFRACTIONf_dihedral_angle_d10.34388880
Refine LS restraints NCS
Ens-IDDom-IDAuth asym-IDRefine-IDタイプRms dev position (Å)
ens_1d_2CX-RAY DIFFRACTIONTorsion NCS0.709455831758
ens_1d_3HX-RAY DIFFRACTIONTorsion NCS0.501651387941
ens_2d_2DX-RAY DIFFRACTIONTorsion NCS0.487978805974
ens_2d_3BX-RAY DIFFRACTIONTorsion NCS1.0041097187
ens_2d_4KX-RAY DIFFRACTIONTorsion NCS0.962930520231
ens_2d_5NX-RAY DIFFRACTIONTorsion NCS0.317206534726
ens_2d_6FX-RAY DIFFRACTIONTorsion NCS0.966815366342
ens_3d_2JX-RAY DIFFRACTIONTorsion NCS0.34182708602
ens_3d_3MX-RAY DIFFRACTIONTorsion NCS0.345870210144
ens_4d_2XX-RAY DIFFRACTIONTorsion NCS0.0946277387367
ens_4d_3YX-RAY DIFFRACTIONTorsion NCS0.0344548969342
LS精密化 シェル
解像度 (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
3.58-3.650.4535280.5258670X-RAY DIFFRACTION22.89
3.65-3.710.5575350.41351043X-RAY DIFFRACTION35.48
3.71-3.780.5411660.40351423X-RAY DIFFRACTION48.84
3.78-3.860.35981610.38012572X-RAY DIFFRACTION90.2
3.86-3.940.39731610.37082873X-RAY DIFFRACTION99.28
3.94-4.040.38111480.372897X-RAY DIFFRACTION99.51
4.04-4.140.41511330.35382877X-RAY DIFFRACTION99.27
4.14-4.250.38691720.33752879X-RAY DIFFRACTION99.51
4.25-4.370.30921590.29692874X-RAY DIFFRACTION99.57
4.37-4.520.33241980.26862850X-RAY DIFFRACTION99.38
4.52-4.680.29731500.2682903X-RAY DIFFRACTION99.38
4.68-4.860.33431460.26032886X-RAY DIFFRACTION99.21
4.86-5.080.32991400.26012929X-RAY DIFFRACTION99.68
5.09-5.350.30151350.26332943X-RAY DIFFRACTION99.45
5.35-5.690.3452000.25622873X-RAY DIFFRACTION99.74
5.69-6.130.33281280.26312976X-RAY DIFFRACTION99.74
6.13-6.740.33131620.27552911X-RAY DIFFRACTION99.87
6.74-7.710.34941250.2623017X-RAY DIFFRACTION99.84
7.72-9.710.25291690.20782985X-RAY DIFFRACTION100
9.71-55.790.25582240.19863072X-RAY DIFFRACTION99.79
精密化 TLS

手法: refined / Refine-ID: X-RAY DIFFRACTION

IDL11 (°2)L12 (°2)L13 (°2)L22 (°2)L23 (°2)L33 (°2)S11 (Å °)S12 (Å °)S13 (Å °)S21 (Å °)S22 (Å °)S23 (Å °)S31 (Å °)S32 (Å °)S33 (Å °)T11 (Å2)T12 (Å2)T13 (Å2)T22 (Å2)T23 (Å2)T33 (Å2)Origin x (Å)Origin y (Å)Origin z (Å)
17.62483076353-0.6916318105082.172592685672.767632446720.9981627663310.9907325338860.05762959481850.188150364934-2.345382349771.591470363330.449125645650.9258902388611.13914372396-0.9211974663480.3077830816221.24432756690.03558055634350.1392840331571.347093835450.7592826959460.947061495719-39.2671809592-35.08724549913.9436192666
21.865856403811.529334561120.3488630175043.123581879160.6880027749190.439877028313-0.1061351844260.4062682384240.1667260547821.657416989150.3227396428050.242980721258-0.145681588024-1.11873833027-0.642552515631.230564940670.2985150397610.1090138980412.48699262270.7625945210641.51920371072-44.3195086892-25.823960898210.2292300276
31.419529641222.19619405093-2.057710352036.69852633842-2.678411292132.861704251260.668823332260.9637046966291.05291022218-0.6967754161890.3221430224910.3693846196151.05299286089-1.11363188456-0.4166199420951.16368340662-0.123383870152-0.04116591217951.866984288060.2978427868261.50854931625-40.9022344357-28.26905880493.71171489002
43.372390330130.1248165904480.3596336907124.89680715964-1.720715834693.38729099414-0.399672135279-1.710956741820.6435244286410.5133658786770.9906864448471.484403352150.0238997761054-1.60516054568-0.4685673388871.067827883540.1483223358520.1818014271791.9623517934-0.2545611087651.38924269908-37.0090879348-24.91171143989.98973697722
51.91303099026-1.35120018352-0.234947162463.35625424861-1.998682007742.763547414590.025875025844-1.99771599984-0.9179687206631.265902678120.5168346377740.1357087065270.351291713769-2.109132308060.1269539629721.138871643020.4158078347670.3866127489871.513919738320.3017973088091.57493156476-17.2411387769-43.645522419330.4020361364
62.392468017840.1615961908141.431687144614.662143128785.254951143396.520470454250.993535760623-0.6321569075120.2325492639271.239178955480.108107101860.3942356953332.38574385047-0.221191688426-0.9811936570241.223840237130.03047657525320.01982486400391.193172799190.8660772363432.08511148293-16.4470245418-40.746871869832.6737889335
73.9325381973-3.16165736805-3.22524345456.327509206925.455774266414.689974218050.369580031176-1.20005836693-0.8792395571830.361258085919-0.415577604777-0.8587439390360.7361527628980.342456867120.04815277120851.191044911080.2012951864440.01894157119691.653228336310.5230997612911.88900060179-22.4352821935-37.069324438331.6988998279
84.04291130709-3.96708571824-1.896752631054.273296090480.7228362754883.869488990160.431065193082-1.730960750490.5522741126851.863512318153.78374267232-0.446598127815-1.176209106440.880839604563-0.6009592007071.339070752970.139390936789-0.2229910574831.518671589840.08060510992981.39722712912-15.5911074853-36.532073525142.5550664525
92.51299492323-0.219337373697-0.6260145140273.230713290673.211826856154.07223039781-0.625805246219-2.65544802027-1.100722066650.5188318256610.6760925829991.064829076330.514119040342-1.52086124445-1.075740646551.555837262220.0506391527047-0.4910038314281.417330893710.6726830467091.74881610825-23.2971008028-45.257573299737.6738938393
105.07548851217-2.446173345970.582843379942.84790196521-0.4177938380998.97887692461-0.861004257647-0.6642534571350.4970427841340.432383696571-0.6012641979690.152707508996-0.4243444716111.210801085992.050775200571.248844918820.0159060595589-0.03117571511061.08262256969-0.07208722585081.11215753369-25.725161398-9.23271362413.3220775133
115.24239171781.12159054484-0.8107261825928.272433200350.2106980347833.77916270823-0.112340309188-1.34262587232-0.443790410.3115228423020.8730862977911.69431532869-1.186975981611.250368341721.025943038781.163292745730.1412017775160.08587143311111.786819264720.1343154571330.88017576134-37.0955268034-10.208274856818.9122051492
121.7372624730.301548284561.302737234921.115791200751.400889309713.35548438535-0.14599845983-0.315148947829-0.3562190290720.3378429101940.0824626665473-0.106248553266-1.3098356037-1.42834026864-0.3163561031161.316131773160.5360612371090.0695207098361.40809019180.06056013199551.17173590728-29.1389450661-7.4827604258618.2759095452
132.26984485799-0.4220903111720.6188448672570.722958813839-2.304417900053.877363720920.479579213264-0.152674745318-0.532406241038-0.2677567375460.620511313827-0.9055199917580.3557328548220.8731595696470.08978515906411.209630535030.3096862913620.2815501605491.118405947690.1063366701430.877675085167-23.6335045442-14.719883488517.998433095
142.09359169521.38716408738-0.8331068577192.42364625463-0.05361256699554.44511050326-0.08862397857970.298517121743-0.683490916096-0.169183731123-0.6016964279610.215482751059-0.5184040067450.7238201625360.1940391732841.093459566690.07813992195240.09986245690680.9908312104330.2705577655021.61657577528-7.78585709513-33.927162043230.8227162536
155.570905269834.413397501681.858837182233.421486995851.742887437414.176082321130.7776434885780.488944346439-1.483138846750.236643548259-0.495100376366-1.054307308560.06849129016040.485215207782-0.2157067360660.9882124515750.0598752449016-0.07958993011041.227750859640.2720234001721.55799385245-5.18406446534-31.743501148328.541370756
161.998742341280.380591800170.5180507486272.088518485060.04466896561482.310201247460.1095446448620.8808939481430.5194974083750.1873366224270.1870148603290.496363006721-0.0784417445775-0.174610757101-0.1412044039941.16932621225-0.03246647282650.103131716421.948198936450.6331659354862.11228413306-42.2354348447-52.0767119051-7.3717644659
174.56276222741-1.071952723881.945540086621.08296053682-1.146775206041.29081532124-1.104256271212.15294361684-1.25155711111-0.4119129900710.0052934136735-0.152794863803-0.5460178798960.240626238071-0.655724688361.28765283164-0.1383299730320.06761794468380.6269927194310.5100650330121.72027008945-44.2611354438-58.2353971242-6.90145256385
184.26199996731-4.048330584551.992956375885.89018104625-0.840389047692.35789393008-0.478851944034-1.291996560181.16361711838-0.0465221372967-0.445969619897-3.80211854460.542662557255-1.222195698580.7085574122151.2323661431-0.6124234544190.1900512995131.426824190960.08958570741821.29979465857-30.6435890003-71.578594810321.3305666144
192.144171911291.687560735290.6013729995275.20681663863-2.443123760852.08476435464-1.03371933133-0.942640948034-0.478370224950.4319782463820.844811879424-3.36403301657-0.589199406437-1.056289128350.3263276089071.234180345820.112396178674-0.2830133643992.02253022252-0.2970859161121.89813617695-29.329742048-72.15303702916.2321172579
205.14125390463-1.015763062921.436096884115.208947490620.2066029949552.089847638450.228464932679-2.33164843575-1.60707576824-0.158840457031-1.36904135967-1.26442294569-0.3752731999930.9729238255950.2734044369941.23414340017-0.238997114371-0.02085347218821.313595051390.4972932101311.89586637754-30.9761341477-75.39978682313.3234034746
212.333758828-0.71170185844-0.24031578774.583290006250.01965427798415.84618739451-1.942382207432.771340691650.4170887960951.390801064960.485431161512-1.748445700650.173946243021.43842958987-0.7871768094350.978880869970.1481212108840.002512000020850.879897204354-0.2863232570343.02859178595-25.0996747901-84.131860870817.8326943979
225.577272809650.8213150391440.07170077657195.718200528070.2247559419075.808582785051.48154745164-0.666252812127-0.884018409922-0.923173481814-0.5805705615410.1210378659480.02132167873222.06473839111-0.3708781419891.28076719581-0.121402153322-0.07081519294891.678499042320.2114846736861.51831283857-21.4978600845-72.013119672418.5272485864
232.44767859420.2837583118491.466789342691.70655084134-1.440330874142.578342846590.525496691007-0.0924696073503-1.0766835517-1.28520887362-0.2021196620880.303824716353-0.0357652876371-0.9721239319610.2563064874191.436723919670.1321104694370.1542998656671.49124379832-0.2912933390031.89354132574-52.6891258079-78.7566205809-7.04772241438
244.812466355642.33340818879-0.07444779791051.349737361950.2865176079190.209546708951-1.277431069122.03617611145-1.74703107156-0.1433505696260.593441181252-1.719307271120.1827734361261.09811661176-0.007983588931791.55143605189-0.2482751908860.1384031110432.06112666183-0.7072014505211.2923550421-55.6480228039-71.1282961579-12.1882032585
253.615986661670.6140593500793.410451496820.1069059773770.2349819902997.345406879742.716620322451.16268659765-2.65685284741-1.134164234540.0123997945728-1.375807140132.398437160580.9842576472520.5044306191981.436525463270.289168061550.1126528487962.66424029406-0.8652280989182.02267924411-44.1884407046-71.7247164984-17.0066908221
262.00820250093-1.228493983070.6055520314660.825033215919-0.302084210230.241450671233-1.129471987732.903554922210.368757866259-0.590957058868-0.405196258223-0.078901379482-0.1334729567481.291637905950.135128946221.67677534927-0.3106246776160.2411941013872.64993469867-0.7464079543832.56208724748-55.8581025261-76.3022369798-16.1964094336
272.333123859681.261623132531.007902668542.1886722838-1.340685168132.764612488161.70422920259-1.86728769733-2.5990676714-0.66856538037-2.0826710665-0.8568369932250.9461344092140.2770073553530.5243424706251.634955357250.29568154578-0.1674916575382.23158351225-0.003888079430142.31713423606-45.0685106326-77.4380068994-11.2094360204
280.520345942571-0.229637863764-0.04867708011532.02451480305-1.397080139251.155289391310.02132612639430.7599489654251.235371780760.343967693394-1.56560624549-1.894978930.5432253070310.8739405302590.454040190441.571662073120.0596739090754-0.1158901439242.05765403266-0.3278259182041.38246649015-49.2559216192-75.8266428336-4.30327993929
293.26573233964-0.54711415604-0.3829033510263.204204046973.625022546084.203068555920.8522262406733.21248119423-0.103041174953-1.73000760112-0.9008935400910.646849889168-0.4623158175871.30973062033-0.3220878529011.64401506251-0.246375261042-0.2756131586990.990757040444-0.2629288415460.709408002589-33.0509453515-79.655530174327.833357259
302.433573960821.837303353191.420325189894.08534584634-1.275898622632.95824551486-0.482197098592-0.545512242508-1.44802120105-1.2657941814-0.401295897148-0.23366491063-0.07171969598130.387982880149-0.6784376210351.16267399261-0.2271395051950.1585190538280.448793032578-1.365833365752.54326062017-37.9848670053-83.128676558318.7929948884
316.335555517570.155329139039-3.717384119883.543112066111.87322886815.24345497309-1.129913976271.32194622896-0.580054747325-0.0998022679568-0.180471550842-0.0936237420303-0.523061848943-1.17231214964-0.8362551377071.036951261220.249295173622-0.4992850533566.98978368786E-6-1.199816841412.64459421845-46.9464383441-85.22314692115.0338608979
324.134619510220.874618736607-2.536090834272.67661753771-4.428763963348.98206775301-1.14843167149-0.313542828497-1.0610104-0.5606743319960.2667890284350.673286632227-1.50447841845-1.34227342605-0.3515866513661.52191834529-0.23393728946-0.3329345773471.39340293520.2281789797342.30351703179-47.8082170446-79.075979581422.6890454136
336.018502871061.09605800365-1.189191571963.15211266869-1.790775806265.18189005132-0.949450484526-2.154756258540.709770787451-1.672829109070.1670194578120.303438791381-1.330332377931.01032530606-0.2430439853011.33114458004-0.06957336458720.469764119330.05174909206210.5018044408172.13362068114-37.80085386-82.290339126711.0452590692
343.05764369851-0.465951991941-2.356411657913.688055728662.520035295365.34753395742-0.241370279711-0.539310573087-0.6309724649741.34009153051-0.655118099809-0.0640249811355-0.1646729654390.761502778494-0.8408488841831.83119461301-0.4756564517870.08282810261190.0912582650174-1.361274932832.08963714766-44.4188218697-82.246611684629.8775071716
351.930910130570.795667351263-1.091108132772.92368988818-1.303045781466.1595875739-0.3916076774191.12842263643-0.4651649936780.309200393369-1.620469610610.5287345009991.60424975786-0.2478118508410.3497868044281.318674617550.3791822471660.06846989533941.159623861240.5209762166222.01985332305-43.858780613-91.785009810422.7748752161
362.8255249575-0.6319951878210.09158722283420.505764248363-1.279608869293.6596179677-0.5185104676760.289185399218-0.478340272632-0.4343810119020.347829118907-2.07955798709-0.5689557076340.6519537644230.1706905181691.426296008880.176672968427-0.05507137685711.16035798175-0.617430249751.44403345464-79.0968925404-11.731984805532.0849407164
375.973711530950.9747288729890.881404267713.19749443844-0.7620755345053.51625068864-0.9277932510761.48330020324-1.87501876446-0.7579189653670.148311578201-1.283525379940.4058935405311.27720961871-0.2897622207951.891967911370.929272418892-0.1949726264421.09234391383-0.5496543397211.02803639628-89.356434189-15.334970624334.5990413477
380.9498723341630.816179042465-0.7653835894840.860995337089-0.3356090715941.100025497921.75011898588-0.04668201083921.11484590210.790695647914-0.6312854325240.1934274923761.002962317780.0380471167982-0.1544905106411.611530745590.590475129205-0.3254822768641.95088676423-0.2249065231721.97099032981-91.7370121803-8.0953643688839.3785227028
396.333373818243.598952261261.335339584364.98243150506-1.076266064751.97030147618-0.8992249082071.064059296491.08078712696-0.2707254220021.74093365862-0.3442743943920.3541291883191.88820578438-0.3873627083091.197287370780.430503197026-0.3183410129461.288539294510.003573572415082.0910527673-89.1805321681-3.3241282153335.5461357689
404.49251932184-1.50090803217-2.668156165473.38926407294-1.496498225263.60928163967-1.228780072782.07836652678-2.16119819643-0.2482707129361.379873431040.9742212965810.858450396210.91596085371-0.4340673897112.134970333390.285932556177-0.6928543911841.473643092940.04587897533471.42974308556-89.0956395286-12.104298544427.8250849992
413.808524970152.37324539835-1.414027437375.92355069353-4.052617662292.678095112480.09821268778261.496930975980.482563258221-0.4795870144681.472403147512.05117507481-0.111142178353-0.4975744594760.2230063690341.528586639010.236245637711-0.2185544916991.11508353113-0.593606211271.3906968253-86.2642549138-12.431843617340.5866320441
420.9231618216730.604545666438-0.6408072097754.32370709477-3.786714836352.4343699711-0.2360031493760.36273043355-0.304308438717-0.494729917491-2.29411979056-3.06804911768-0.7058271962020.993851626404-1.620937885631.064914045050.981846789924-0.181371292665-1.260852734660.9716869494940.845675846954-52.076891623-11.156297248944.5189253842
438.050819211020.324285244658-3.417398115729.436240206441.970326690291.91864949369-1.908238971681.76306288234-2.56048650976-1.25678513141-0.586315995516-0.6576506435392.888020319311.23934222187-5.581484874781.28673137322-0.650292420281-0.2838314806590.334754036283-0.7970792682591.00044749097-56.7555804951-18.137462624739.7115376587
448.33292570657-0.981477249644-3.255427147490.4406393234341.283396674723.911327218661.263008647631.314523312781.91861501345-0.9956043460790.759378234153-0.515471277728-1.806412243740.7218618053081.110272690791.47355700501-0.758876177538-0.7252976879830.249144334928-0.3235279658890.937050585083-58.3201171952-15.225284403747.1146926139
454.316044144160.592938983172-2.419932549790.739746374688-0.01246354085651.91261024238-1.46545288292-0.682208417369-1.66593365650.9956472424080.4986699552650.1508000705740.3366014082381.25998570997-0.2511741215811.220597219530.128875256072-0.1808538221581.309453131170.05325537303031.14875222465-47.5877632067-21.987433544149.5724402678
464.133087754840.2236335874431.371792922445.62103508989-1.053740428526.219896241560.277888169390.855207948023-0.590207323678-0.979633791303-0.438467730051-0.863708738620.7982911480682.92764636571-0.5337423472451.54027969417-0.135305713492-0.01826188659041.71839183332-0.1000627567861.28627126032-49.5166489167-17.438440619137.9627303381
473.537555020571.49518359660.4982255947062.661079518581.441156770572.522032018360.3248045018630.712925216116-0.2532971213270.595345289496-1.49165936411-0.361287226539-0.702277254939-0.67517893606-0.06551424944911.343910312870.113699284692-0.03894184423591.24824720843-0.1750619555181.2892452588-87.2405633117-17.160437075159.5859847444
482.372496911281.651479338610.9393039101133.34632234536-1.683024984312.318433614740.368912357610.0374000965092-1.278475216170.127627490687-1.039786173430.514992025857-0.1018931619430.2721189139240.0753532330261.421037430580.14997467799-0.2129584220271.37033019136-0.2014222371371.90433983493-87.8146367907-24.386542323454.9661398176
491.49143795534-0.694800376267-0.4102318819010.6704401201830.9907870032841.036637399010.0282961850675-0.770191083789-3.223840684690.3702095933340.8124629591680.915418784351-1.12374287652-0.6743000028150.04366204710141.229298428970.3040804469860.1366707876070.7893783618350.09021725309621.55454613057-80.024511949-17.255926659857.5547621822
503.08320272652.18410653631-1.400070501346.13207632516-0.2816738003060.366382853988-0.469843375062-1.58942460879-0.170846413809-0.07116832451280.35183199870.330840057419-0.1124348970540.6047789576510.1146967424221.389093973670.2589220014590.03698762866721.01243544132-0.09930980207630.876588946882-53.7500863959-9.131519094457.8526530333
512.80745566873-1.649351228681.292292133443.7621902643-3.679953168295.877368908180.587843283481-1.15969921488-2.016465424970.77631268206-1.33386483914-0.328618609858-0.03483333518711.370353527640.3183375371231.040555028010.0705375255996-0.1341060700810.836663686303-0.02185254781430.561396243981-53.4837606759-10.783686451260.6163281887
521.50095437411-1.27606393195-0.622796695671.320115838921.743947761495.20142351408-0.737260376698-1.175295514020.03781231454280.7189502536290.7241045122022.382258943490.7673514009071.150083879640.4605416587720.7999328877050.2376924741910.05446352880291.22468862541-0.03952932644842.44294722706-116.0323812855.3259142847744.8336511221
532.435989430690.6201685032250.7014031576660.736865049565-0.02986810749170.2684426849591.680956052341.83240260158-0.631573943098-0.843380266278-1.53218161494-1.81800767833-3.91462733660.993447175912-0.2360481881373.78802017240.5537305179710.0989568154752.57072391253-0.1464529023111.01277512484-105.0334182471.7734869849837.3554873667
542.77866878534-1.08888921875-1.666516657862.784283405991.502621062740.9065984257750.369451485188-0.386943932793-0.3814412521630.3355719918660.2839647402530.05732577810880.1994292370530.198018804063-0.207066222341.20151270222-0.0328214982452-0.2040694721171.29730144814-0.1775153089721.52235825148-105.4525952916.8769088925952.5889594894
550.2994472999440.7784576826750.2382754107051.990846855070.5464788573240.08005865021440.443082531534-0.8230244707371.858839096550.848402928395-0.1254999356590.0775238035044-0.3234352265691.15853347342-0.1978256087521.60131579666-0.322964947889-0.1681556193181.73870770962-0.4167442452272.24138587616-112.66937570113.197975204368.6768046195
560.853492164507-0.234727559582-0.7282058874992.197945898531.672880833883.87376556377-0.182876613059-0.06251944408370.8045944218040.0639555698076-0.2702855094051.44758356699-0.2282795919580.247601452199-0.2375092293521.155307601130.130598306457-0.1345378619551.178775144840.02838660640791.79924331879-108.34740066812.221001533755.5735685424
573.568413611481.148418703021.364019534866.12906272404-2.636623577172.3258509295-1.236014643971.07594513618-0.4352845778940.4262463686091.540281745-0.43948824153-1.2411800149-0.6723502314840.7404106586961.644362551380.419735974723-0.09734897216781.552948148440.1214791742881.72228913485-106.59658885843.450036458131.6695136044
585.179301238025.71666307932-0.247318216167.10783729250.4714022647240.6052936620830.03213219327291.347966127211.43762622877-1.79259736760.6183148483262.314908809180.6847869087921.570442843171.43000862341.469951297650.785930934493-0.1312324576012.374715583330.4916066819771.5445522382-107.31867370636.321305821410.6356377085
591.041150577811.443415450123.20156934432.242084087143.502936327052.00463746117-0.0559893196187-0.240556546434-2.417612326150.565122849671.84689504316-1.32401699986-1.986790005033.16110859746-0.1631941230231.549328693710.401028588530.3268124287742.475588167590.7179247274212.29717889241-101.95251794737.10011535330.3445588274
606.740055285410.474570193261-0.5735952845832.713901315211.444734297461.56463354584-0.05227263326741.083554370460.001232814829381.46986492289-0.605962968558-0.823885361072-0.07058132926430.5360171265510.01810346711071.41340858374-0.142635684674-0.3822361279231.24292598169-0.4972503470581.85550819885-115.49372684931.776603640324.8356886489
616.03890461832.955308830281.629488683234.885977458170.1026570922123.6380256149-1.809984573230.822405544577-1.02055743742-0.84853395302-0.975431641378-0.447824652073-1.90615263147-1.887630185980.6456006878311.219987063350.26557682897-0.1299828028551.63291776193-0.3114675242163.42849218113-108.67668055723.524647172424.4473611788
628.161152810922.351695979544.334618223647.752514688231.55973899589.053686316071.00533842779-2.35220655747-0.270863940950.165985243355-0.921638099225-4.237264921931.878422364592.374863490290.9215346022771.31606055750.3656440513150.01482821631232.111002529960.1082444486961.52378107417-101.90336681932.490453839824.3827474927
632.96286613131-2.89228927792-3.062711738144.600140088245.531000127646.632005321321.391072501030.513033911058-1.56649764934-0.926919374714-0.1206461396550.474718503015-0.396133609547-0.313865224955-0.5658167381741.663233286510.300537798496-0.2691525248171.22702107297-0.01978054394271.53192085379-112.47684326233.112829427118.4900180878
645.00508152902-0.355702329888-0.7393763284636.45977092142-0.6528346710255.17624494638-0.242015997628-0.1746870092820.8258888061581.12150574031-0.1118427710311.4371746269-1.276780320072.832591493350.7937286107991.08765212639-0.181278240174-0.1447049490061.59413282437-0.004768655876391.42844080494-111.25312775738.802737020227.6005343749
656.792911038265.683390510235.382346302534.760555708264.504955381184.25734695584-2.009180258380.6154817204810.304726277728-1.28268630907-0.04301888284890.1177757183220.8674286105611.30279201198-2.051344448532.66637632707-0.193124325833-0.3593696381541.39835744481.098204044161.31335444154-115.47091209646.62440291910.779053719432
660.839934704664-0.5028132429010.4352841669220.706606375385-0.8344206445190.9658068353190.0710537403254-1.46465664952-0.4274467916090.4807248945810.601076827511-0.2169926844681.097169147570.139996651127-0.4243822038321.10611015914-0.495572107372-0.01580437357041.36863951427-0.2693164848371.67513306398-137.8920011362.94354051738.34546028312
671.40940701102-0.610450709802-0.4832297993611.074108753340.4810254616220.722447301762-0.729811356587-0.7541776971411.49097579041-0.365904577962-0.2411232943581.80317432123-0.243619832242-1.14997667915-1.46587562341.13128347236-0.56508159329-0.4814785249720.261872247558-1.680950654141.51671870714-130.81750383859.08843948139.34384909465
681.87078445606-0.0338152709185-2.239400558686.20644892548-4.266397809435.80117382249-0.175424815132-1.367830200532.66508995281.60135804175-1.06901988237-1.13152570701-1.012602735551.31092737766-0.004781564214740.9381182708360.0264008193435-0.1946469546791.21496479465-0.5070387547491.75316523073-119.42508971155.85874709959.240361119
697.32282983091-6.225048463585.32952778786.12111717054-4.125833230554.082849778480.677668017706-0.725406313988-0.4207043786451.553321723041.531380645490.51988453576-1.323390504070.73153796593-2.766805393651.110360072-0.791600894660.6470612673641.60936506756-0.4876064864862.40164905566-122.99840619371.803963670211.5468821139
702.437508916141.59412787170.2555420591271.968647636980.01816185474541.98848901884-0.180797053710.03368282661280.09184121516640.0005493511835981.19690716415-0.07942314903530.9060092489370.5055839121440.2591017514111.41616303912-0.6487764988730.3532777344841.845718571-0.4451278918772.02612945559-125.37155552258.964632640917.6927364168
711.94469265042.22759579375-0.4703170059724.648952913850.1128879376067.469749350610.827989735466-0.6328571128910.3276639874470.1581245231621.668725948452.138035025143.20748344509-1.884509447690.1164938294062.00988965761-0.224537197171-0.1662829503740.7967205090340.005879984830681.5772997132-122.67079395541.94014125937.229444944
720.522788980479-1.432782398850.150813069495.176152859972.321338026817.95621925126-0.287441025676-0.1194013385270.825121859190.00116124601035-0.288462738132-0.6683874545770.3811448671622.03525212615-0.1525790822861.21188490944-0.270633427565-0.01386541964810.215470844746-0.1661080953442.35290626049-126.57014202465.16534248139.36838801588
730.01570148718860.2846210650130.1793438473034.302011518013.023555265532.19330535693-0.6764265773150.8010831648030.1109483394860.0486437960695-2.20896298598-0.154564972021.240212142121.965615164821.932097468791.416248558010.373746904850.380670737431.637836515240.2854343649441.58720180802-130.19292544968.30760439872.12402801925
744.303319122-0.5958718806770.7192695594746.286579669862.071039332163.572059113490.771223624886-0.0668382229870.358986108871-1.45492345443-0.6914693284191.73835087568-1.06960414263-0.542973921850.01002440134951.354235090560.3486728974560.2877634185511.114016765640.3532633137651.37789194868-134.01359192136.093336569338.5749505576
752.812255565173.96644728315-2.913956266196.10984554483-5.660585996077.841585910450.44416680866-0.2287954123350.4349578551081.25706132865-0.6809773205410.0921670633952-1.391288627130.1665388969681.092831675241.630260336410.003652449340670.7114329131460.73371674510.3202487575884.38732923214-122.95231679620.198842002841.3770310475
764.66633489993.75372393722-0.4305288991064.607681824641.541760195092.97710136719-0.229631429883.933513418320.468379576633-1.687003700530.634015104922-1.2617221409-0.48734939751.19137760948-0.5748832185581.17324870775-0.2738942814060.05516022311051.497080492710.9857342567790.908564369403-123.56281570338.748884926532.9887638739
775.20269184817-0.8276384124372.631881291375.43359020775-0.4566970651411.929780546820.300073581447-1.96449368525-0.7284424554990.406635573584-0.3498799303130.100559834280.5095737125971.08668407654-0.4604389952181.336268835560.02612258029130.204672795530.948955973920.03225062519941.32534448878-123.47563709634.766717304444.9309833796
782.203745252421.45261020125-1.86835953064.67065921457-0.111223424031.91586096380.799191388584-0.300822786802-0.00196422211235-0.5686997155930.599592696852-0.8055495326780.287747886656-1.116345830691.228811212721.3865419004-0.2497944563920.04150049730050.7064008641650.3309144410981.27587821686-126.51022435540.688959461836.7671703773
792.171670013260.00565323390501-2.380575546676.191247987931.904025168813.33597318072-0.123983933478-1.23164506582-1.53627132192-0.007818464999-0.06092063434830.2016358498440.6378153178741.57249624627-0.3484924667511.433150258690.04983637110960.05016591065851.042509970410.09167087790982.8191274087-111.31264900726.068108609140.2970379555
802.110893138932.432283781561.850182087095.67462213702-1.32535803045.6663837260.2076350454120.4636790568470.9654016665761.02828621395-1.59762743474-2.66879984210.9636643415150.6339727541920.02106320376161.397034115720.5931001318620.3728880473570.153843211020.1037271675511.8701127917-128.35939559936.321444528132.2991209147
818.62456515486-4.10844036701-6.608639719931.995982070122.928273284885.42650224654-0.8581262326890.0650939535213-0.2411727854310.258491340148-0.1171278321091.6205983353-0.894033319551-1.168587288771.502142880041.25325082477-0.188627879278-0.08772134582762.10045755736-0.8285589307082.3033442185-143.2917535454.891746906918.9525228531
828.67129791080.735563101241-5.561741421582.77358636971-2.848436597165.654138993180.6603522301070.009131306996490.384271338287-1.337360149-0.0103134026745-0.8801782179140.0192034597722-0.01221348795671.242866185381.47313251832-0.8509239235870.5568101652072.527661883450.009277052798430.910753342464-135.62542652959.2012399982-3.1626402471
832.614784697670.189287860062-1.48187790322.76820387097-1.624226050051.75142353986-0.04226303759360.352776811184-0.5626429364560.4449928335480.4467606131621.154312951612.452692336080.0698786581395-0.08837501204621.52465389497-0.0446101923737-0.4965284543521.28000903651-0.3001461427122.59843298663-138.20559853551.464418096215.245623801
840.9512278194522.23580476725-0.2699395947915.64852095071-1.61799691132.37481782414-0.444495078401-0.206474614230.46522604180.486907332140.1140236389770.109241919946-1.819003478070.01191896438130.8487317807951.71396267575-0.263956145934-0.2652347351141.12610653107-1.677877077293.37868536669-141.80157241144.03546740816.94935812369
854.09620243137-1.50386643198-1.982575840771.97127178903-1.791750669855.579668468280.3005470876741.499142656930.675855013958-0.396996839985-1.569321200430.8887897263160.886627004399-0.0983041971305-0.5473772613241.14992805593-0.115277167617-0.1568638651451.15694364887-0.473880090582.15939154151-133.78150322349.290009890814.2571715643
861.71792896117-0.445563529705-0.9867033868351.730967672660.6775362769760.636356146519-0.2980988231430.232160241967-2.78612257085-1.371140549590.57227396212-0.762221390143-0.47915899758-0.8640382980420.4718066305031.56259677945-0.3297685167920.0181935740821.748110913130.0918342389661.41089417749-140.54879529749.06898453336.2377189182
875.55315120058-4.029517454931.19399026927.420368481660.6738681615665.213023664010.249014723108-0.722176681341.80922352517-1.60667512665-2.751959785142.4285626486-1.07493844389-1.254424340540.8702995459441.64492941681-0.108046244928-0.8622197470261.22324724820.1324565815952.25133616633-146.77339858254.34349404066.18615838282
888.459708484563.99096361377-2.780845875771.97325775245-1.867487878445.09101368162-0.4626323882760.9786666131212.45678040182-0.8817647715110.498240099230.6836397905210.0742546749794-0.407153117986-0.9601814036231.240136479230.1727407993840.00685571225321.754436626230.4049468421540.422016149575-41.9904204945-13.5266430514-22.7458696752
893.35269856588-0.01147915037650.8432656201597.443247168380.4232044316662.24503833389-0.194377114753-0.1429375676190.4954070709790.559254335002-0.1388806633440.00946136069779-0.173815046244-0.4193264790760.6857052460842.09650449331-0.006104822210471.570224452690.437864037436-0.03419694409263.60032713926-43.8131154664-23.0518702405-12.9620969167
903.621290407121.963043942181.047310253623.92344217763-2.223976952935.41613213832-0.359319411295-0.7665300494790.211545208967-0.02156905129790.522121670407-0.992502454991-0.3332294976561.07391989181-0.1454769626211.140775199260.03590451490.02264488166891.15938817099-0.1817886349481.58104869019-32.755480858-14.8353458062-13.7481586279
915.60539986371.254582692390.6040174182691.806273653560.1275074170111.40697261038-0.790542539827-1.754702326610.3893192149650.553969057747-0.964206284909-0.0007987398809081.528898823661.58850404107-0.8426633992911.97909132286-0.0235504781240.6875720514231.240766280590.3412021696831.40623289215-21.2673127664-17.5069272321-28.6143593151
921.85209315257-0.68543364507-0.9177539007780.675837007420.1761918072050.4403355849341.36818735608-0.253309142361-0.475338498011-0.400708739934-0.2122929684340.300793134363-0.5057634163710.423539604975-0.3358016619551.339144727570.139962217481-0.09151061172641.85663612044-0.1184104294411.48593188195-18.8393053301-3.88555613273-26.3590446703
933.894716920531.67310105673-1.364086934920.109086931691-0.5436239204382.32760287702-0.1699104965391.26716929107-0.910945767305-0.3485495232490.0668460912197-0.5459757058220.1153534103520.117375430888-0.2049971881631.359886398220.2150710548110.1090421373271.25069500688-0.09684346314491.3613877924-27.1241959547-14.4193076898-22.9194608508
944.242247900850.419825361839-2.387575523770.2008018011230.03791652530263.12825555990.645188518787-1.19520509786-1.71841124576-1.067245205440.0457493711210.07681853616210.0345963625506-0.7524421966750.1077222056231.72155172888-0.313120821005-0.1992955563481.163816179590.3739297358281.50549090753-42.8638092703-52.7189573873-41.4045648431
952.273289440584.325663411940.772326695332.06995917943.128513151471.518011279280.41729574651-2.61168084339-1.495679591541.11809692130.780196590626-2.06721882273-0.6175335566480.2739071755072.724583125971.44358129115-0.05124989174110.387143457831.24580242021-0.0466252536548-0.00733777434682-39.9776154731-43.4618662091-39.5608370228
965.94908667827-1.05867501513-1.100020121173.426269482011.386436392340.67253893602-0.4803100911950.6964832402941.343125049280.0455280587248-1.224928680181.242770117450.305691090816-0.2376810618860.8442794688871.166860073580.1077566432830.05287499632492.22458674025-0.06274946960470.939297459728-46.1309311425-45.6707830435-33.8610269995
975.543657026266.04266966981-2.291301505591.994423435075.545210039182.028244373521.472483402880.136708571140.107975640999-0.6621815431620.942739154391-3.17956516038-1.04500987132.54920751413-0.6608542089381.309593185060.1262792119470.103478559870.8955442200270.3765643299941.1696542671-35.7104825265-41.416969553-43.4810264229
985.33690877464-1.897223091670.9239869064941.128385610621.324892571155.92426810627-0.223832525223-1.34550489432-0.899617368728-0.860300107665-1.12650228490.4030267383265.20287199478-2.151892901980.1487237499532.1858975994-0.076331619812-0.2082406231281.959331753420.03413220324830.67056483308-53.6224562517-58.8550448397-48.6541236707
990.941231487668-0.8770298204910.2147806811570.63181241049-0.08515035635950.875963608573-0.2134466641390.436663160386-0.266391269433-1.38036391165-0.559406879194-0.9228042459140.5385594827360.103237689480.6159754676313.12060097323-0.324024273448-0.1786422228261.049696042140.4038457873631.92511930804-54.118864358-56.6477016565-71.6314860879
1008.995813907-0.369517197892-1.936073135080.338808473729-0.8656693358243.143875173351.09925787388-2.21460688137-1.682844153030.403448941222-1.782183531130.3718825794341.38123200151-1.87388060449-0.1931462957852.8405290729-0.6851877283620.2933649358972.32389225441-1.194177365791.99905379276-43.6614932911-63.7008602666-72.2656879151
1011.910271110450.813029239899-0.5940502177050.52165820043-0.426409933770.966524944129-0.535332329420.670686985560.779289619946-0.7910553425180.323351171335-0.403126583681-0.07765748996590.548313727012-1.519696699792.62942471296-0.837304389858-0.281722456378-1.51689334943-1.456313370381.17332601028-52.6961622153-53.8987480571-59.5586814879
1027.067131682730.153506709063-1.454116115492.7459350396-0.1027611908370.3034418508630.370346290653-0.635437009897-1.10373780754-1.387216782530.1821931420880.0856968552554-2.120493670351.559731008040.7404066389823.12890242338-0.92061184647-0.1184223314971.095153081870.3780814224261.24790530564-49.4211204942-62.7776525532-75.0499752564
1037.10498342338-2.60475197754-4.639455795543.90976922472-0.0650473668644.00742096199-1.80171843019-0.253245235544-1.58957511645-0.264662590305-0.0147386222636-0.802706055870.8579539384850.23456453973-1.651617354471.96500882546-0.35219308810.182761469940.710152799761-0.01925146436231.56849397534-42.4690868359-22.7393522662-52.5150231993
1043.65459214492-2.21443638712-1.803263253593.73917597557-2.046161975354.67936491456-1.5722726719-1.096081326890.0296770445231-0.7697114044430.956968022433-1.3877935462-0.0818983509705-0.298099480043-0.4264991022992.02827928001-0.4404759617360.3767828543830.158111098154-0.4776863436921.58042553733-36.8468091661-28.8357225745-49.8647466099
1050.6503999493550.06687955409390.005427245733320.3906908125950.0326458151352.60757608338-1.019991942730.271490379344-1.44109232177-3.616074635270.994711286223-0.03494427092921.249772535790.7736390372790.9958166646353.69812271313-1.12314121659-0.1273738784780.94173552790.5247756074311.67698063909-55.4062157151-46.819913714-76.6254959246
1062.37907247085-1.487046216321.774144700433.684305788933.442960253758.583059059940.8389483198330.2689567970030.0960859257175-1.21729518894-1.397949732141.90602880476-0.393901614054-2.36272454829-0.07331473879992.46345674725-0.261700176364-0.1786253734342.03745272677-0.08678037450581.1885694314-57.4959346764-45.98912346-69.2880496338
1070.0655278743823-0.401681165717-0.7765850050461.352059321322.302503233084.12179348827-0.2591781209440.2558863376330.501138913316-0.907685322224-0.5167407940150.320895620409-2.35433032712-0.492936874176-0.09328738615573.0821219775-0.58639943369-0.3952816283781.43855853150.124325991391.79017383242-64.7672379336-48.8559275278-74.2162177945
1083.8644644687-0.144517397759-0.1199926247790.01821154289250.1781957451343.17921950155-0.707213522732-0.726425906872-0.942856288817-0.2199588298-0.0258679865505-0.1209746498210.068129358693-0.5621309716231.150235655641.062797580710.0728512367049-0.2650330920062.403793017650.2132462528761.55313248271-71.1653039366-40.030740803-19.2323514444
1090.0352606035493-0.1661008537510.383815370980.756007262224-2.41702123837.920989664621.824101606593.09894237756-0.0527624312293-1.5856534851-0.652988542068-2.62798954244-1.840288033442.82681807923-0.7242797325762.274828152290.2991392217160.1503085906262.6320456221-0.128184715832.83753323496-58.57677912-40.6625583888-13.6847683019
1101.940613556751.49517277889-0.3019206365876.51093661081-0.7316121618752.19972506268-0.246114300379-0.885912008249-0.91037628390.0315918781659-0.323417616629-0.08413521859190.376708955977-0.04848448603450.03150267168551.07748899239-0.1269174791050.1001044988581.7432822720.3302735633521.21553775203-68.3979176224-50.1223288431-11.5889810415
1113.48272678539-0.974949641245-0.6111152278750.424012856810.3477845012551.48238318422-0.02207142208040.252307797404-0.7127757209062.204031095691.14946771629-0.8536856344090.9595750421630.273439399764-0.1240300480341.1896991171-0.109391131493-0.04783089618771.801623405670.2764959320271.25888285402-83.615505687-44.4761095599-1.78702367761
1121.04973945861-0.0411594824058-1.43263766557-0.04276863386720.0208313557893.05622977149-0.293410728216-2.05448469766-0.166295391816-0.655242533515-0.3536297271030.424800737433-0.08663031468190.2981404027930.15453414941.34724530627-0.0761901087098-0.02022092596131.668235333850.1363160510041.59027999338-89.5929309028-54.4876989461-9.59728834492
1132.774919066613.16635227504-1.468792199053.29550341904-0.1724023014471.35425168660.84043719601-0.237119004475-0.05486023366830.850223456619-0.0751637150477-0.424962044504-0.437328917230.6132601841960.1560778952961.4787769516-0.1468792535330.04187767650541.764319764330.3101704342091.19860604683-78.0616618125-46.997746982-8.02490705451
1142.276688977670.716249091759-3.783671438664.357938804970.9720241373356.749912305550.9537958250550.1302664130980.02480461715421.33221974287-0.0808065464121-0.996080033834-1.69501173202-0.485574469277-0.1807551547841.363799032550.149331616624-0.03744474154751.740389299490.07015547608411.73965180561-65.2040698226-5.690294887116.59214162751
1153.97626171574-1.25957330336-1.241825236873.788555134713.521995242613.268252442970.9231423109120.836304331957-1.0457694918-0.306344148684-1.59979569733-0.3619653578821.728045405881.896023881170.06701986554191.341925554910.0135959977224-0.0006197806964521.638495577270.173573692351.34676159888-69.6955330198-13.54248843012.64357152803
1162.39167924430.8273054611452.070580366563.100526172931.978466036166.299142990130.5582255813840.334025320952-0.836548848366-0.469565041790.1195758696860.1745381619840.306622741280.731078031486-0.5232341112731.049852536050.2759366377340.1111280258861.342966653320.3577362111161.44671527873-61.751135803-12.8449365496-0.782807411269
1172.50772406522-0.6023810350050.5175864427172.015328079640.329841490667-0.347771774557-0.396839967578-1.378249517820.3284502340690.654365792120.827204775381-0.138475813171-0.624381614749-0.445470564215-0.01350934760881.916853868490.5122132978070.3077504066422.318615231750.2061570291921.51254823099-76.53819774994.957245015213.01663902424
1184.589217189321.40157915731-0.6453107435041.85355034967-0.08579811869169.008012833620.457422566912-0.5870609475760.5430382229751.517534316650.700092221387-0.66008858698-0.3958998071180.0274346728205-1.07458991631.55378974150.242612859970.008831938340741.599116722590.1680445263721.93670187883-79.550815138317.40791975118.75375733769
1190.6657597500470.417626899718-0.2617911924853.17633393744-1.756239497860.9786989813061.509135030291.010751586960.265025933502-1.70838818431-3.035975465970.1036998898563.46937731627-3.11219945823-0.09787093085311.843534155830.292270865372-0.09022857519812.0134891161-0.6806640445461.62300742372-68.131574324110.9999833972-3.74851771641
1200.383907665002-0.2449961681250.7830473176111.8399245217-2.289047283364.960039346790.336130298849-0.3770488122590.754963659762-1.54066742722-0.9741514861811.68635928020.401027172037-0.665024322658-1.006504915881.151380350510.2125763317750.2490771862510.749045424326-0.5362804894382.4731329292-91.249707072322.97471899948.71492442158
1210.0801080976812-0.2758361700080.154814668722.286576250080.5242502062251.495936297430.5965148271521.20678193241-0.892143011686-0.08130446210030.6789995209211.551778278510.220540708449-1.10817185226-1.298411353451.01688552676-0.08336514530050.5302601812753.14834007388-0.2429661003413.20381757563-80.080191127824.409691584112.3804835421
1220.0905848659875-0.0203241416544-0.0328351970702-0.0187778170005-0.00166671777933-0.0112484351812.06252208884-0.739620275050.00507260112344-0.640833034376-1.823971088671.1790170684-0.06721871299630.1068406719030.287416166971.615914206520.441300197589-0.4031749147582.6179726547-0.4903515230112.33247889041-75.894306368327.246968970410.5016084529
1233.77252766968-1.34438058372-3.965792546415.44844128731-1.870910091766.95089905709-0.6828488736530.198290108835-1.259950746610.3144909961630.3874584994090.9161287541741.41810897089-0.4561007156821.05433149331.354842344820.234335459365-0.1843492761082.48719833439-0.05451060963351.1700415449-89.3005095653-14.8371699071-11.9814912516
1240.5274882006781.07988525247-0.6109593225964.043393573081.299555044336.425400727450.3387634500690.490736574528-0.270161901227-0.4590912094890.03663978903980.1132103268340.2707778386460.05126795716410.07067587737861.28287249946-0.0312513218046-0.09646056324072.07189569621-0.08581075316481.60663451778-86.3534423379-16.4697742288-3.95867389564
1250.2440102129151.49050024214-0.6522016838084.07017944471-2.26960681873.6509290726-1.08835141748-0.8783093342112.32440425293-0.5697871643840.6923058077651.7787311747-0.280047359644-0.09783583963370.4074742900811.585977075990.470468575635-0.4018263943422.20503671529-0.1079330625552.50962141508-85.31737957920.4335596935-8.0445396227
精密化 TLSグループ

Refine-ID: X-RAY DIFFRACTION

IDRefine TLS-IDSelection detailsAuth asym-IDLabel asym-IDAuth seq-IDLabel seq-ID
11chain 'M' and (resid 1 through 17 )MA1 - 171 - 17
22chain 'M' and (resid 18 through 40 )MA18 - 4018 - 40
33chain 'M' and (resid 41 through 83 )MA41 - 8341 - 83
44chain 'M' and (resid 84 through 119 )MA84 - 11984 - 119
55chain 'M' and (resid 120 through 143 )MA120 - 143120 - 137
66chain 'M' and (resid 144 through 153 )MA144 - 153138 - 147
77chain 'M' and (resid 154 through 183 )MA154 - 183148 - 177
88chain 'M' and (resid 184 through 201 )MA184 - 201178 - 195
99chain 'M' and (resid 202 through 221 )MA202 - 221196 - 215
1010chain 'N' and (resid 1 through 38 )NB1 - 381 - 38
1111chain 'N' and (resid 39 through 61 )NB39 - 6139 - 61
1212chain 'N' and (resid 62 through 90 )NB62 - 9062 - 90
1313chain 'N' and (resid 91 through 114 )NB91 - 11491 - 114
1414chain 'N' and (resid 115 through 151 )NB115 - 151115 - 151
1515chain 'N' and (resid 152 through 212 )NB152 - 212152 - 212
1616chain 'J' and (resid 1 through 83 )JC1 - 831 - 83
1717chain 'J' and (resid 84 through 119 )JC84 - 11984 - 119
1818chain 'J' and (resid 120 through 143 )JC120 - 143120 - 137
1919chain 'J' and (resid 144 through 162 )JC144 - 162138 - 156
2020chain 'J' and (resid 163 through 183 )JC163 - 183157 - 177
2121chain 'J' and (resid 184 through 201 )JC184 - 201178 - 195
2222chain 'J' and (resid 202 through 221 )JC202 - 221196 - 215
2323chain 'K' and (resid 1 through 18 )KD1 - 181 - 18
2424chain 'K' and (resid 19 through 38 )KD19 - 3819 - 38
2525chain 'K' and (resid 39 through 61 )KD39 - 6139 - 61
2626chain 'K' and (resid 62 through 75 )KD62 - 7562 - 75
2727chain 'K' and (resid 76 through 90 )KD76 - 9076 - 90
2828chain 'K' and (resid 91 through 114 )KD91 - 11491 - 114
2929chain 'K' and (resid 115 through 129 )KD115 - 129115 - 129
3030chain 'K' and (resid 130 through 140 )KD130 - 140130 - 140
3131chain 'K' and (resid 141 through 151 )KD141 - 151141 - 151
3232chain 'K' and (resid 152 through 164 )KD152 - 164152 - 164
3333chain 'K' and (resid 165 through 183 )KD165 - 183165 - 183
3434chain 'K' and (resid 184 through 199 )KD184 - 199184 - 199
3535chain 'K' and (resid 200 through 212 )KD200 - 212200 - 212
3636chain 'E' and (resid 1 through 17 )EE1 - 171 - 17
3737chain 'E' and (resid 18 through 40 )EE18 - 4018 - 40
3838chain 'E' and (resid 41 through 60 )EE41 - 6041 - 60
3939chain 'E' and (resid 61 through 73 )EE61 - 7361 - 73
4040chain 'E' and (resid 74 through 83 )EE74 - 8374 - 83
4141chain 'E' and (resid 84 through 119 )EE84 - 11984 - 119
4242chain 'E' and (resid 120 through 153 )EE120 - 153120 - 147
4343chain 'E' and (resid 154 through 165 )EE154 - 165148 - 159
4444chain 'E' and (resid 166 through 183 )EE166 - 183160 - 177
4545chain 'E' and (resid 184 through 201 )EE184 - 201178 - 195
4646chain 'E' and (resid 202 through 221 )EE202 - 221196 - 215
4747chain 'F' and (resid 1 through 38 )FF1 - 381 - 38
4848chain 'F' and (resid 39 through 90 )FF39 - 9039 - 90
4949chain 'F' and (resid 91 through 114 )FF91 - 11491 - 114
5050chain 'F' and (resid 115 through 164 )FF115 - 164115 - 164
5151chain 'F' and (resid 165 through 212 )FF165 - 212165 - 212
5252chain 'R' and (resid 334 through 364 )RG334 - 3641 - 31
5353chain 'R' and (resid 365 through 375 )RG365 - 37532 - 42
5454chain 'R' and (resid 376 through 459 )RG376 - 45943 - 126
5555chain 'R' and (resid 460 through 479 )RG460 - 479127 - 146
5656chain 'R' and (resid 480 through 527 )RG480 - 527147 - 194
5757chain 'L' and (resid 1 through 7 )LH1 - 71 - 7
5858chain 'L' and (resid 8 through 18 )LH8 - 188 - 18
5959chain 'L' and (resid 19 through 32 )LH19 - 3219 - 32
6060chain 'L' and (resid 33 through 48 )LH33 - 4833 - 48
6161chain 'L' and (resid 49 through 61 )LH49 - 6149 - 61
6262chain 'L' and (resid 62 through 75 )LH62 - 7562 - 75
6363chain 'L' and (resid 76 through 90 )LH76 - 9076 - 90
6464chain 'L' and (resid 91 through 107 )LH91 - 10791 - 107
6565chain 'L' and (resid 108 through 113 )LH108 - 113108 - 113
6666chain 'L' and (resid 114 through 128 )LH114 - 128114 - 128
6767chain 'L' and (resid 129 through 137 )LH129 - 137129 - 137
6868chain 'L' and (resid 138 through 150 )LH138 - 150138 - 150
6969chain 'L' and (resid 151 through 155 )LH151 - 155151 - 155
7070chain 'L' and (resid 156 through 163 )LH156 - 163156 - 163
7171chain 'L' and (resid 164 through 174 )LH164 - 174164 - 174
7272chain 'L' and (resid 175 through 204 )LH175 - 204175 - 204
7373chain 'L' and (resid 205 through 213 )LH205 - 213205 - 213
7474chain 'H' and (resid 2 through 25 )HI2 - 251 - 24
7575chain 'H' and (resid 26 through 33 )HI26 - 3325 - 32
7676chain 'H' and (resid 34 through 44 )HI34 - 4433 - 43
7777chain 'H' and (resid 45 through 83 )HI45 - 8344 - 82
7878chain 'H' and (resid 84 through 99 )HI84 - 9983 - 98
7979chain 'H' and (resid 100 through 111 )HI100 - 11199 - 110
8080chain 'H' and (resid 112 through 125 )HI112 - 125111 - 124
8181chain 'H' and (resid 126 through 136 )HI126 - 136125 - 135
8282chain 'H' and (resid 137 through 146 )HI137 - 146136 - 141
8383chain 'H' and (resid 147 through 162 )HI147 - 162142 - 157
8484chain 'H' and (resid 163 through 169 )HI163 - 169158 - 164
8585chain 'H' and (resid 170 through 187 )HI170 - 187165 - 182
8686chain 'H' and (resid 188 through 215 )HI188 - 215183 - 210
8787chain 'H' and (resid 216 through 228 )HI216 - 228211 - 223
8888chain 'Y' and (resid 334 through 364 )YJ334 - 3641 - 31
8989chain 'Y' and (resid 365 through 375 )YJ365 - 37532 - 42
9090chain 'Y' and (resid 376 through 442 )YJ376 - 44243 - 109
9191chain 'Y' and (resid 443 through 459 )YJ443 - 459110 - 126
9292chain 'Y' and (resid 460 through 479 )YJ460 - 479127 - 146
9393chain 'Y' and (resid 480 through 527 )YJ480 - 527147 - 194
9494chain 'D' and (resid 1 through 18 )DK1 - 181 - 18
9595chain 'D' and (resid 19 through 48 )DK19 - 4819 - 48
9696chain 'D' and (resid 49 through 83 )DK49 - 8349 - 83
9797chain 'D' and (resid 84 through 101 )DK84 - 10184 - 101
9898chain 'D' and (resid 102 through 113 )DK102 - 113102 - 113
9999chain 'D' and (resid 114 through 143 )DK114 - 143114 - 143
100100chain 'D' and (resid 144 through 155 )DK144 - 155144 - 155
101101chain 'D' and (resid 156 through 174 )DK156 - 174156 - 174
102102chain 'D' and (resid 175 through 213 )DK175 - 213175 - 213
103103chain 'C' and (resid 2 through 33 )CL2 - 331 - 32
104104chain 'C' and (resid 34 through 123 )CL34 - 12333 - 122
105105chain 'C' and (resid 124 through 146 )CL124 - 146123 - 141
106106chain 'C' and (resid 147 through 187 )CL147 - 187142 - 182
107107chain 'C' and (resid 188 through 228 )CL188 - 228183 - 223
108108chain 'X' and (resid 334 through 364 )XM334 - 3641 - 31
109109chain 'X' and (resid 365 through 375 )XM365 - 37532 - 42
110110chain 'X' and (resid 376 through 442 )XM376 - 44243 - 109
111111chain 'X' and (resid 443 through 459 )XM443 - 459110 - 126
112112chain 'X' and (resid 460 through 479 )XM460 - 479127 - 146
113113chain 'X' and (resid 480 through 527 )XM480 - 527147 - 194
114114chain 'B' and (resid 1 through 18 )BN1 - 181 - 18
115115chain 'B' and (resid 19 through 48 )BN19 - 4819 - 48
116116chain 'B' and (resid 49 through 83 )BN49 - 8349 - 83
117117chain 'B' and (resid 84 through 128 )BN84 - 12884 - 128
118118chain 'B' and (resid 129 through 163 )BN129 - 163129 - 163
119119chain 'B' and (resid 164 through 174 )BN164 - 174164 - 174
120120chain 'B' and (resid 175 through 188 )BN175 - 188175 - 188
121121chain 'B' and (resid 189 through 198 )BN189 - 198189 - 198
122122chain 'B' and (resid 199 through 213 )BN199 - 213199 - 213
123123chain 'A' and (resid 2 through 33 )AO2 - 331 - 32
124124chain 'A' and (resid 34 through 123 )AO34 - 12333 - 122
125125chain 'A' and (resid 124 through 228 )AO124 - 228123 - 223

+
万見について

-
お知らせ

-
2022年2月9日: EMDBエントリの付随情報ファイルのフォーマットが新しくなりました

EMDBエントリの付随情報ファイルのフォーマットが新しくなりました

  • EMDBのヘッダファイルのバージョン3が、公式のフォーマットとなりました。
  • これまでは公式だったバージョン1.9は、アーカイブから削除されます。

関連情報:EMDBヘッダ

外部リンク:wwPDBはEMDBデータモデルのバージョン3へ移行します

-
2020年8月12日: 新型コロナ情報

新型コロナ情報

URL: https://pdbj.org/emnavi/covid19.php

新ページ: EM Navigatorに新型コロナウイルスの特設ページを開設しました。

関連情報:Covid-19情報 / 2020年3月5日: 新型コロナウイルスの構造データ

+
2020年3月5日: 新型コロナウイルスの構造データ

新型コロナウイルスの構造データ

関連情報:万見生物種 / 2020年8月12日: 新型コロナ情報

外部リンク:COVID-19特集ページ - PDBj / 今月の分子2020年2月：コロナウイルスプロテーアーゼ

+
2019年1月31日: EMDBのIDの桁数の変更

EMDBのIDの桁数の変更

  • EMDBエントリに付与されているアクセスコード(EMDB-ID)は4桁の数字(例、EMD-1234)でしたが、間もなく枯渇します。これまでの4桁のID番号は4桁のまま変更されませんが、4桁の数字を使い切った後に発行されるIDは5桁以上の数字(例、EMD-12345)になります。5桁のIDは2019年の春頃から発行される見通しです。
  • EM Navigator/万見では、接頭語「EMD-」は省略されています。

関連情報:Q: 「EMD」とは何ですか？ / 万見/EM NavigatorにおけるID/アクセスコードの表記

外部リンク:EMDB Accession Codes are Changing Soon! / PDBjへお問い合わせ

+
2017年7月12日: PDB大規模アップデート

PDB大規模アップデート

  • 新バージョンのPDBx/mmCIF辞書形式に基づくデータがリリースされました。
  • 今回の更新はバージョン番号が4から5になる大規模なもので、全エントリデータの書き換えが行われる「Remediation」というアップデートに該当します。
  • このバージョンアップで、電子顕微鏡の実験手法に関する多くの項目の書式が改定されました(例：em_softwareなど)。
  • EM NavigatorとYorodumiでも、この改定に基づいた表示内容になります。

外部リンク:wwPDB Remediation / OneDepデータ基準に準拠した、より強化された内容のモデル構造ファイルが、PDBアーカイブで公開されました。

-
万見 (Yorodumi)

幾万の構造データを、幾万の視点から

  • 万見(Yorodumi)は、EMDB/PDB/SASBDBなどの構造データを閲覧するためのページです。
  • EM Navigatorの詳細ページの後継、Omokage検索のフロントエンドも兼ねています。

関連情報:EMDB / PDB / SASBDB / 3つのデータバンクの比較 / 万見検索 / 2016年8月31日: 新しいEM Navigatorと万見 / 万見文献 / Jmol/JSmol / 機能・相同性情報 / 新しいEM Navigatorと万見の変更点

他の情報も見る