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- PDB-8t7f: Structure of the S1 variant of Fab F1 -

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基本情報

登録情報
データベース: PDB / ID: 8t7f
タイトルStructure of the S1 variant of Fab F1
要素
  • S1 variant of Fab F1 heavy chain
  • S1 variant of Fab F1 light chain
キーワードIMMUNE SYSTEM / enhanced crystallization / EphA2 binding / engineered protein / Fab
生物種Homo sapiens (ヒト)
手法X線回折 / シンクロトロン / 分子置換 / 解像度: 3.5 Å
データ登録者Singer, A.U. / Bruce, H.A. / Enderle, L. / Blazer, L. / Adams, J.J. / Sicheri, F. / Sidhu, S.S.
資金援助1件
組織認可番号
Other private
引用
ジャーナル: Protein Sci. / : 2024
タイトル: Engineered antigen-binding fragments for enhanced crystallization of antibody:antigen complexes.
著者: Bruce, H.A. / Singer, A.U. / Filippova, E.V. / Blazer, L.L. / Adams, J.J. / Enderle, L. / Ben-David, M. / Radley, E.H. / Mao, D.Y.L. / Pau, V. / Orlicky, S. / Sicheri, F. / Kurinov, I. / ...著者: Bruce, H.A. / Singer, A.U. / Filippova, E.V. / Blazer, L.L. / Adams, J.J. / Enderle, L. / Ben-David, M. / Radley, E.H. / Mao, D.Y.L. / Pau, V. / Orlicky, S. / Sicheri, F. / Kurinov, I. / Atwell, S. / Kossiakoff, A.A. / Sidhu, S.S.
#1: ジャーナル: J.Mol.Biol. / : 2018
タイトル: Locking the Elbow: Improved Antibody Fab Fragments as Chaperones for Structure Determination.
著者: Bailey, L.J. / Sheehy, K.M. / Dominik, P.K. / Liang, W.G. / Rui, H. / Clark, M. / Jaskolowski, M. / Kim, Y. / Deneka, D. / Tang, W.J. / Kossiakoff, A.A.
#2: ジャーナル: Plos One / : 2020
タイトル: Rapid and robust antibody Fab fragment crystallization utilizing edge-to-edge beta-sheet packing.
著者: Lieu, R. / Antonysamy, S. / Druzina, Z. / Ho, C. / Kang, N.R. / Pustilnik, A. / Wang, J. / Atwell, S.
履歴
登録2023年6月20日登録サイト: RCSB / 処理サイト: RCSB
改定 1.02023年11月22日Provider: repository / タイプ: Initial release
改定 1.12024年1月10日Group: Database references / カテゴリ: citation / citation_author
Item: _citation.journal_volume / _citation.title ..._citation.journal_volume / _citation.title / _citation.year / _citation_author.name
改定 1.22024年10月23日Group: Structure summary
カテゴリ: pdbx_entry_details / pdbx_modification_feature
Item: _pdbx_entry_details.has_protein_modification

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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

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集合体

登録構造単位
C: S1 variant of Fab F1 heavy chain
G: S1 variant of Fab F1 light chain
A: S1 variant of Fab F1 heavy chain
B: S1 variant of Fab F1 light chain
D: S1 variant of Fab F1 heavy chain
E: S1 variant of Fab F1 light chain
F: S1 variant of Fab F1 heavy chain
H: S1 variant of Fab F1 light chain
I: S1 variant of Fab F1 heavy chain
J: S1 variant of Fab F1 light chain
K: S1 variant of Fab F1 heavy chain
L: S1 variant of Fab F1 light chain
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)293,53616
ポリマ-292,86712
非ポリマー6694
00
1
C: S1 variant of Fab F1 heavy chain
G: S1 variant of Fab F1 light chain
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)49,0503
ポリマ-48,8112
非ポリマー2381
0
タイプ名称対称操作
identity operation1_555x,y,z1
2
A: S1 variant of Fab F1 heavy chain
B: S1 variant of Fab F1 light chain


分子量 (理論値)分子数
合計 (水以外)48,8112
ポリマ-48,8112
非ポリマー00
0
タイプ名称対称操作
identity operation1_555x,y,z1
3
D: S1 variant of Fab F1 heavy chain
E: S1 variant of Fab F1 light chain
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)49,1464
ポリマ-48,8112
非ポリマー3342
0
タイプ名称対称操作
identity operation1_555x,y,z1
4
F: S1 variant of Fab F1 heavy chain
H: S1 variant of Fab F1 light chain


分子量 (理論値)分子数
合計 (水以外)48,8112
ポリマ-48,8112
非ポリマー00
0
タイプ名称対称操作
identity operation1_555x,y,z1
5
I: S1 variant of Fab F1 heavy chain
J: S1 variant of Fab F1 light chain


分子量 (理論値)分子数
合計 (水以外)48,8112
ポリマ-48,8112
非ポリマー00
0
タイプ名称対称操作
identity operation1_555x,y,z1
6
K: S1 variant of Fab F1 heavy chain
L: S1 variant of Fab F1 light chain
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)48,9073
ポリマ-48,8112
非ポリマー961
0
タイプ名称対称操作
identity operation1_555x,y,z1
単位格子
Length a, b, c (Å)80.757, 189.456, 216.468
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 1 through 2 and (name N...
d_2ens_1(chain "C" and ((resid 1 through 2 and (name N...
d_3ens_1(chain "D" and ((resid 1 through 2 and (name N...
d_4ens_1(chain "F" and ((resid 1 through 2 and (name N...
d_5ens_1(chain "I" and ((resid 1 through 2 and (name N...
d_6ens_1(chain "K" and ((resid 1 through 2 and (name N...
d_1ens_2(chain "B" and (resid 4 through 54 or resid 74...
d_2ens_2(chain "E" and (resid 4 through 17 or (resid 18...
d_3ens_2(chain "G" and (resid 4 through 17 or (resid 18...
d_4ens_2(chain "H" and (resid 4 through 23 or (resid 24...
d_5ens_2(chain "J" and (resid 4 through 23 or (resid 24...
d_6ens_2(chain "L" and (resid 4 through 17 or (resid 18...

NCSドメイン領域:
Dom-IDComponent-IDEns-IDBeg auth comp-IDBeg label comp-IDEnd auth comp-IDEnd label comp-IDAuth asym-IDLabel asym-IDAuth seq-IDLabel seq-ID
d_11ens_1GLUGLUPROPROAC1 - 1501 - 142
d_12ens_1THRTHRPROPROAC159 - 237151 - 229
d_21ens_1GLUGLUPROPROCA1 - 1501 - 142
d_22ens_1THRTHRPROPROCA159 - 237151 - 229
d_31ens_1GLUGLUPROPRODE1 - 1501 - 142
d_32ens_1THRTHRPROPRODE159 - 237151 - 229
d_41ens_1GLUGLUPROPROFG1 - 1501 - 142
d_42ens_1THRTHRPROPROFG159 - 237151 - 229
d_51ens_1GLUGLUPROPROII1 - 1501 - 142
d_52ens_1THRTHRPROPROII159 - 237151 - 229
d_61ens_1GLUGLUPROPROKK1 - 1501 - 142
d_62ens_1THRTHRPROPROKK159 - 237151 - 229
d_11ens_2METMETILEILEBD4 - 544 - 48
d_12ens_2SERSERARGARGBD74 - 22960 - 213
d_21ens_2METMETSERSEREF4 - 264 - 26
d_22ens_2VALVALILEILEEF29 - 5429 - 48
d_23ens_2SERSERARGARGEF74 - 22960 - 213
d_31ens_2METMETSERSERGB4 - 264 - 26
d_32ens_2VALVALILEILEGB29 - 5429 - 48
d_33ens_2SERSERARGARGGB74 - 22960 - 213
d_41ens_2METMETSERSERHH4 - 264 - 26
d_42ens_2VALVALILEILEHH29 - 5429 - 48
d_43ens_2SERSERARGARGHH74 - 22960 - 213
d_51ens_2METMETSERSERJJ4 - 264 - 26
d_52ens_2VALVALILEILEJJ29 - 5429 - 48
d_53ens_2SERSERARGARGJJ74 - 22960 - 213
d_61ens_2METMETSERSERLL4 - 264 - 26
d_62ens_2VALVALARGARGLL29 - 22929 - 213

NCSアンサンブル:
ID
ens_1
ens_2

NCS oper:
IDCodeMatrixベクター
1given(-0.994357398402, 0.105958528353, -0.00511414826382), (0.105980969338, 0.994358703559, -0.00433621899005), (0.00462583845462, -0.00485375382419, -0.999977521094)-36.9353308606, 2.55181674948, 107.675819678
2given(0.991436622514, -0.130545512694, -0.00336045431744), (-0.0700815229741, -0.510172777953, -0.857211943905), (0.11019076039, 0.8501068202, -0.51495280422)-4.98503007365, -11.5164814898, 115.876387741
3given(0.991778346736, -0.0656117097133, 0.109867258521), (-0.127934174442, -0.488745926122, 0.862994940141), (-0.00292539848038, -0.869955471991, -0.493121606499)-8.41952368174, -104.718413299, 48.3541815939
4given(-0.994074057264, 0.0606104568165, -0.090239355042), (0.0458334425366, -0.519040232962, -0.853520083016), (-0.0985700979971, -0.852598152174, 0.513186444374)-34.5322847959, -9.72074217691, -7.80156738262
5given(-0.999516590054, -0.0309823572684, 0.00258452021292), (0.0174029509561, -0.488667471182, 0.872296532096), (-0.0257628318448, 0.871919833555, 0.48897042891)-42.8770363065, -103.055665571, 60.2092857653
6given(0.990689896925, -0.13592198692, 0.00766430703413), (-0.0628612793211, -0.506659744502, -0.859851360913), (0.120755901275, 0.851364267968, -0.510486920043)-6.522114063, -11.0472940174, 115.785308763
7given(-0.993613213307, 0.110912633458, -0.0207646353302), (0.110919557007, 0.993829048129, 0.000821564091854), (0.020727619602, -0.00148688721499, -0.99978405416)-35.1229959065, 2.27031766154, 108.107229575
8given(0.989344006546, -0.0855662742987, 0.11780003996), (-0.14466588854, -0.486365314844, 0.861696327722), (-0.0164382908161, -0.869555744745, -0.493561130333)-10.1536723969, -104.745123135, 48.1362976472
9given(-0.994193344102, 0.051335506372, -0.0945740996685), (0.0532400622214, -0.529110004919, -0.846881395751), (-0.0935151876288, -0.84699897785, 0.523304539635)-34.2985501494, -10.7650210235, -8.51494009738
10given(-0.99963667132, -0.0263080474815, -0.0058661734268), (0.00778733974528, -0.490237718233, 0.871553978226), (-0.0258047029174, 0.871191635784, 0.490264470513)-41.9840070528, -103.458123162, 60.1180100101

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要素

#1: 抗体
S1 variant of Fab F1 heavy chain


分子量: 25332.188 Da / 分子数: 6 / 由来タイプ: 組換発現 / 詳細: engineered Fab from phage display / 由来: (組換発現) Homo sapiens (ヒト) / プラスミド: pSCSTa / 細胞株 (発現宿主): Expi293 / 発現宿主: Homo sapiens (ヒト)
#2: 抗体
S1 variant of Fab F1 light chain


分子量: 23479.033 Da / 分子数: 6 / Mutation: Q165S, K167Y, Q217A / 由来タイプ: 組換発現
詳細: Fab produced by randomization of CDR regions and selected by phage display
由来: (組換発現) Homo sapiens (ヒト) / プラスミド: pSCSTa / 細胞株 (発現宿主): Expi293 / 発現宿主: Homo sapiens (ヒト)
#3: 化合物 ChemComp-EPE / 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID / HEPES / HEPES


分子量: 238.305 Da / 分子数: 2 / 由来タイプ: 合成 / : C8H18N2O4S / タイプ: SUBJECT OF INVESTIGATION / コメント: pH緩衝剤*YM
#4: 化合物 ChemComp-SO4 / SULFATE ION / 硫酸ジアニオン


分子量: 96.063 Da / 分子数: 2 / 由来タイプ: 合成 / : SO4 / タイプ: SUBJECT OF INVESTIGATION
研究の焦点であるリガンドがあるかY
Has protein modificationY

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実験情報

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実験

実験手法: X線回折 / 使用した結晶の数: 1

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試料調製

結晶マシュー密度: 2.83 Å3/Da / 溶媒含有率: 56.49 %
結晶化温度: 298 K / 手法: 蒸気拡散法, シッティングドロップ法 / pH: 6.5
詳細: 20% PEG3350, 200 mM ammonium sulfate, 100 mM Bis-Tris HCl, pH 6.5

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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: APS / ビームライン: 21-ID-E / 波長: 0.97918 Å
検出器タイプ: DECTRIS EIGER X 16M / 検出器: PIXEL / 日付: 2020年11月24日 / 詳細: Mirrors
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: 0.97918 Å / 相対比: 1
反射解像度: 3.5→95.04 Å / Num. obs: 40200 / % possible obs: 93.1 % / 冗長度: 6.7 % / Biso Wilson estimate: 91.74 Å2 / CC1/2: 0.997 / Rmerge(I) obs: 0.178 / Rpim(I) all: 0.074 / Rrim(I) all: 0.193 / Net I/σ(I): 7.9
反射 シェル解像度: 3.5→3.64 Å / 冗長度: 6.7 % / Rmerge(I) obs: 1.001 / Mean I/σ(I) obs: 2.1 / Num. unique obs: 4729 / CC1/2: 0.789 / Rpim(I) all: 0.411 / % possible all: 99

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解析

ソフトウェア
名称バージョン分類
PHENIX1.20.1_4487精密化
PHENIX1.20.1_4487精密化
MOSFLMデータ削減
Aimless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: PDB entry 3DVN
解像度: 3.5→94.73 Å / SU ML: 0.5512 / 交差検証法: FREE R-VALUE / σ(F): 1.34 / 位相誤差: 34.0687
立体化学のターゲット値: GeoStd + Monomer Library + CDL v1.2
Rfactor反射数%反射
Rfree0.306 1909 4.81 %
Rwork0.2426 37818 -
obs0.2457 39727 92.92 %
溶媒の処理減衰半径: 0.9 Å / VDWプローブ半径: 1.11 Å / 溶媒モデル: FLAT BULK SOLVENT MODEL
原子変位パラメータBiso mean: 96.55 Å2
精密化ステップサイクル: LAST / 解像度: 3.5→94.73 Å
タンパク質核酸リガンド溶媒全体
原子数18925 0 40 0 18965
拘束条件
Refine-IDタイプDev ideal
X-RAY DIFFRACTIONf_bond_d0.005219458
X-RAY DIFFRACTIONf_angle_d0.996426655
X-RAY DIFFRACTIONf_chiral_restr0.05223030
X-RAY DIFFRACTIONf_plane_restr0.00783396
X-RAY DIFFRACTIONf_dihedral_angle_d16.41436456
Refine LS restraints NCS
Ens-IDDom-IDAsym-IDAuth asym-IDRefine-IDタイプRms dev position (Å)
ens_1d_2CAX-RAY DIFFRACTIONTorsion NCS0.821858333969
ens_1d_3CAX-RAY DIFFRACTIONTorsion NCS0.885436182616
ens_1d_4CAX-RAY DIFFRACTIONTorsion NCS0.90758503456
ens_1d_5CAX-RAY DIFFRACTIONTorsion NCS0.840924331263
ens_1d_6CAX-RAY DIFFRACTIONTorsion NCS0.913377162534
ens_2d_2DBX-RAY DIFFRACTIONTorsion NCS1.15876365001
ens_2d_3DBX-RAY DIFFRACTIONTorsion NCS1.11143077976
ens_2d_4DBX-RAY DIFFRACTIONTorsion NCS1.19254338191
ens_2d_5DBX-RAY DIFFRACTIONTorsion NCS1.2618909854
ens_2d_6DBX-RAY DIFFRACTIONTorsion NCS1.28649475367
LS精密化 シェル
解像度 (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
3.5-3.590.42061390.33452818X-RAY DIFFRACTION99.83
3.59-3.680.4154680.35811394X-RAY DIFFRACTION48.25
3.69-3.790.37981330.35382764X-RAY DIFFRACTION96.92
3.79-3.920.4387910.3261670X-RAY DIFFRACTION58.78
3.92-4.060.37561520.29982841X-RAY DIFFRACTION98.32
4.06-4.220.3521450.26732868X-RAY DIFFRACTION99.93
4.22-4.410.27261630.23812850X-RAY DIFFRACTION99.87
4.41-4.640.27311480.21372880X-RAY DIFFRACTION99.97
4.64-4.930.27621580.21712861X-RAY DIFFRACTION99.6
4.93-5.310.28161420.22292924X-RAY DIFFRACTION99.9
5.31-5.850.31041280.23352937X-RAY DIFFRACTION99.93
5.85-6.690.28641260.2572953X-RAY DIFFRACTION99.84
6.69-8.430.30591510.23562960X-RAY DIFFRACTION99.9
8.43-94.730.2611650.18473098X-RAY DIFFRACTION99.21
精密化 TLS

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

IDL112)L122)L132)L222)L232)L332)S11 (Å °)S12 (Å °)S13 (Å °)S21 (Å °)S22 (Å °)S23 (Å °)S31 (Å °)S32 (Å °)S33 (Å °)T112)T122)T132)T222)T232)T332)Origin x (Å)Origin y (Å)Origin z (Å)
12.81027558531-1.20850613682-0.9122764914964.53345172694.061184423613.44171803558-0.36680538168-0.72846585705-0.1028665550090.967155276010.688211069815-0.3322724717550.9821871257991.35253934347-0.3054317481390.6436310326930.065148159236-0.02601061955840.8685416166640.1570281704420.537058953199-33.1336932749-46.975714052237.0086947929
24.09200925865-1.97345815166-2.717554933362.818037770983.031875709916.66808857971-0.4278810698450.009240218363020.12696071618-0.208021180958-0.0189692188868-0.007546048947580.02458786098870.1751734219990.454388269570.6417336032190.00379385136959-0.07414954137060.3225397512090.1039214403650.612361294251-43.0760635743-44.232075790634.5798710003
37.66062967009-3.83386782512-7.128907578692.857576525593.569302262518.78054466042-0.05242121513920.110577030776-0.1923215674120.0132052584293-0.345842205426-0.159498092516-0.00203281318964-0.06266860462970.3847397274140.4330435965380.0219376510356-0.06122100094670.477378186040.08327433259930.543960526811-40.5019434105-45.895671219933.830321662
42.75722264163-1.48812012291-1.320829751887.4734970053-0.68932321153.85190242064-0.02897517972810.2883080565990.3778888363870.155487174678-0.118645344685-0.88550445535-0.2799838652670.762195789130.1773877870560.521897720036-0.00657964733054-0.07522141409090.9262137794080.04846651277110.599907392459-17.7796292305-41.73884461484.65999230682
55.11816761121.68131391439-1.872621140855.42487100941-3.13584719946.905532908920.3929241196660.1496964842761.520572530450.155558610903-0.004745130550190.548487849989-1.75712973317-0.596626641903-0.3726564623231.142538945430.1878542231220.1266822317550.5940001665650.01699304411950.711767246056-44.3581802879-26.513721680127.5620516328
62.1189341647-0.572438102361-1.300357859245.76604648837-0.564114241177.439604915820.2997536635130.427335086610.181071683834-0.0300971135244-0.418491731511-0.372248965673-0.518193412878-0.1520962083460.1135886835070.427105292225-0.00739970910659-0.008007714711490.7610158997340.1749501193360.498471152127-31.0467257827-36.475763619-2.33961828998
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554.846721195521.349986314231.89159540893.754616101223.017181526042.913022678120.460391723336-1.042935913511.045280240271.24928029666-0.4833756261310.6288230023370.789836122253-0.0504686534402-0.1109525676420.978344219193-0.08813251403810.1114489538480.967979048272-0.05166700809040.595872855363-39.5147029428-6.8982344403874.7629882622
563.841617946681.87410697101-2.718074710093.66543994054-1.591966773958.867131343810.549631394245-0.6699727086731.338317846610.4446332043480.2124917553420.482429792775-1.01006285310.197493195146-0.7285184662340.7163837307470.06455036220670.08423910019160.780954021623-0.4185012715341.31585234356-30.760517482913.238018778281.0565464248
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 'C' and (resid 1 through 34 )CA1 - 341 - 33
22chain 'C' and (resid 35 through 67 )CA35 - 6734 - 60
33chain 'C' and (resid 68 through 143 )CA68 - 14361 - 135
44chain 'C' and (resid 144 through 238 )CA144 - 238136 - 226
55chain 'G' and (resid 2 through 116 )GB2 - 1161 - 95
66chain 'G' and (resid 117 through 231 )GB117 - 23196 - 210
77chain 'A' and (resid 1 through 18 )AC1 - 181 - 17
88chain 'A' and (resid 19 through 67 )AC19 - 6718 - 60
99chain 'A' and (resid 68 through 99 )AC68 - 9961 - 91
1010chain 'A' and (resid 100 through 124 )AC100 - 12492 - 116
1111chain 'A' and (resid 125 through 143 )AC125 - 143117 - 135
1212chain 'A' and (resid 144 through 169 )AC144 - 169136 - 156
1313chain 'A' and (resid 170 through 181 )AC170 - 181157 - 168
1414chain 'A' and (resid 182 through 199 )AC182 - 199169 - 186
1515chain 'A' and (resid 200 through 212 )AC200 - 212187 - 199
1616chain 'A' and (resid 213 through 239 )AC213 - 239200 - 226
1717chain 'B' and (resid 4 through 100 )BD4 - 1001 - 72
1818chain 'B' and (resid 101 through 152 )BD101 - 15273 - 124
1919chain 'B' and (resid 153 through 230 )BD153 - 230125 - 202
2020chain 'D' and (resid 1 through 18 )DE1 - 181 - 17
2121chain 'D' and (resid 19 through 45 )DE19 - 4518 - 40
2222chain 'D' and (resid 46 through 67 )DE46 - 6741 - 60
2323chain 'D' and (resid 68 through 106 )DE68 - 10661 - 98
2424chain 'D' and (resid 107 through 130 )DE107 - 13099 - 122
2525chain 'D' and (resid 131 through 181 )DE131 - 181123 - 168
2626chain 'D' and (resid 182 through 191 )DE182 - 191169 - 178
2727chain 'D' and (resid 192 through 237 )DE192 - 237179 - 224
2828chain 'E' and (resid 2 through 100 )EF2 - 1001 - 80
2929chain 'E' and (resid 101 through 229 )EF101 - 22981 - 209
3030chain 'F' and (resid 1 through 45 )FG1 - 451 - 40
3131chain 'F' and (resid 46 through 99 )FG46 - 9941 - 91
3232chain 'F' and (resid 100 through 143 )FG100 - 14392 - 135
3333chain 'F' and (resid 144 through 239 )FG144 - 239136 - 225
3434chain 'H' and (resid 2 through 44 )HH2 - 441 - 37
3535chain 'H' and (resid 45 through 120 )HH45 - 12038 - 98
3636chain 'H' and (resid 121 through 168 )HH121 - 16899 - 146
3737chain 'H' and (resid 169 through 204 )HH169 - 204147 - 182
3838chain 'H' and (resid 205 through 229 )HH205 - 229183 - 207
3939chain 'I' and (resid 1 through 107 )II1 - 1071 - 99
4040chain 'I' and (resid 108 through 143 )II108 - 143100 - 135
4141chain 'I' and (resid 144 through 239 )II144 - 239136 - 224
4242chain 'J' and (resid 3 through 44 )JJ3 - 441 - 36
4343chain 'J' and (resid 45 through 75 )JJ45 - 7537 - 57
4444chain 'J' and (resid 76 through 100 )JJ76 - 10058 - 80
4545chain 'J' and (resid 101 through 116 )JJ101 - 11681 - 96
4646chain 'J' and (resid 117 through 139 )JJ117 - 13997 - 119
4747chain 'J' and (resid 140 through 165 )JJ140 - 165120 - 145
4848chain 'J' and (resid 166 through 183 )JJ166 - 183146 - 163
4949chain 'J' and (resid 184 through 197 )JJ184 - 197164 - 177
5050chain 'J' and (resid 198 through 229 )JJ198 - 229178 - 209
5151chain 'K' and (resid 1 through 107 )KK1 - 1071 - 99
5252chain 'K' and (resid 108 through 143 )KK108 - 143100 - 135
5353chain 'K' and (resid 144 through 239 )KK144 - 239136 - 224
5454chain 'L' and (resid 3 through 100 )LL3 - 1001 - 71
5555chain 'L' and (resid 101 through 139 )LL101 - 13972 - 110
5656chain 'L' and (resid 140 through 229 )LL140 - 229111 - 200

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万見について

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お知らせ

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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

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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

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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

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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

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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。

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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