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- PDB-8cp4: [4Fe-4S] cluster containing LarE in complex with AMP -

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データを開く


IDまたはキーワード:

読み込み中...

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基本情報

登録情報
データベース: PDB / ID: 8cp4
タイトル[4Fe-4S] cluster containing LarE in complex with AMP
要素NAD_synthase domain-containing protein
キーワードTRANSFERASE / LAR / SULFUR TRANSFERASE / LARE / AMP / 4FE-4S / THIOLATION / [FE-S] CLUSTER / IRON-SULFUR CLUSTER / PP-LOOP / ATP PYROPHOSPHATASE / LACTATE / LACTATE RACEMIZATION
機能・相同性
機能・相同性情報


sulfurtransferase activity / 4 iron, 4 sulfur cluster binding / nucleotide binding / metal ion binding
類似検索 - 分子機能
Pyridinium-3,5-bisthiocarboxylic acid mononucleotide synthase LarE / : / NAD/GMP synthase / NAD synthase / Rossmann-like alpha/beta/alpha sandwich fold
類似検索 - ドメイン・相同性
ADENOSINE MONOPHOSPHATE / IRON/SULFUR CLUSTER / NAD/GMP synthase domain-containing protein
類似検索 - 構成要素
生物種Methanococcus maripaludis (古細菌)
手法X線回折 / シンクロトロン / 分子置換 / 解像度: 3.19 Å
データ登録者Zecchin, P. / Pecqueur, L. / Golinelli-Pimpaneau, B.
資金援助 フランス, 1件
組織認可番号
French National Research AgencyANR-11-LABX-0011 フランス
引用ジャーナル: Protein Sci. / : 2024
タイトル: Structure-based insights into the mechanism of [4Fe-4S]-dependent sulfur insertase LarE.
著者: Zecchin, P. / Pecqueur, L. / Oltmanns, J. / Velours, C. / Schunemann, V. / Fontecave, M. / Golinelli-Pimpaneau, B.
履歴
登録2023年3月1日登録サイト: PDBE / 処理サイト: PDBE
改定 1.02024年1月31日Provider: repository / タイプ: Initial release
改定 1.12024年2月7日Group: Database references / Refinement description / カテゴリ: citation / struct_ncs_dom_lim
Item: _citation.journal_volume / _citation.year ..._citation.journal_volume / _citation.year / _struct_ncs_dom_lim.beg_auth_asym_id / _struct_ncs_dom_lim.beg_auth_comp_id / _struct_ncs_dom_lim.beg_auth_seq_id / _struct_ncs_dom_lim.beg_label_asym_id / _struct_ncs_dom_lim.beg_label_seq_id / _struct_ncs_dom_lim.end_auth_asym_id / _struct_ncs_dom_lim.end_auth_comp_id / _struct_ncs_dom_lim.end_auth_seq_id / _struct_ncs_dom_lim.end_label_asym_id / _struct_ncs_dom_lim.end_label_seq_id

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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
A: NAD_synthase domain-containing protein
B: NAD_synthase domain-containing protein
C: NAD_synthase domain-containing protein
D: NAD_synthase domain-containing protein
E: NAD_synthase domain-containing protein
F: NAD_synthase domain-containing protein
G: NAD_synthase domain-containing protein
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)221,33226
ポリマ-218,1337
非ポリマー3,19919
724
1
A: NAD_synthase domain-containing protein
ヘテロ分子

A: NAD_synthase domain-containing protein
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)63,86310
ポリマ-62,3242
非ポリマー1,5408
0
タイプ名称対称操作
identity operation1_555x,y,z1
point symmetry operation1
2
B: NAD_synthase domain-containing protein
D: NAD_synthase domain-containing protein
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)63,1698
ポリマ-62,3242
非ポリマー8456
362
タイプ名称対称操作
identity operation1_555x,y,z1
3
C: NAD_synthase domain-containing protein
E: NAD_synthase domain-containing protein
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)63,1337
ポリマ-62,3242
非ポリマー8105
181
タイプ名称対称操作
identity operation1_555x,y,z1
4
F: NAD_synthase domain-containing protein
G: NAD_synthase domain-containing protein
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)63,0986
ポリマ-62,3242
非ポリマー7744
0
タイプ名称対称操作
identity operation1_555x,y,z1
単位格子
Length a, b, c (Å)186.170, 212.690, 196.740
Angle α, β, γ (deg.)90.000, 90.000, 90.000
Int Tables number20
Space group name H-MC2221
Space group name HallC2c2
Symmetry operation#1: x,y,z
#2: x,-y,-z
#3: -x,y,-z+1/2
#4: -x,-y,z+1/2
#5: x+1/2,y+1/2,z
#6: x+1/2,-y+1/2,-z
#7: -x+1/2,y+1/2,-z+1/2
#8: -x+1/2,-y+1/2,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 16 through 19 or (resid 20...
d_2ens_1(chain "B" and (resid 16 through 140 or (resid 141...
d_3ens_1(chain "C" and (resid 16 through 19 or (resid 20...
d_4ens_1(chain "D" and (resid 16 through 19 or (resid 20...
d_5ens_1(chain "E" and (resid 16 through 19 or (resid 20...
d_6ens_1(chain "F" and (resid 16 through 19 or (resid 20...
d_7ens_1(chain "G" and (resid 16 through 19 or (resid 20...

NCSドメイン領域:

Ens-ID: ens_1

Dom-IDComponent-IDBeg auth comp-IDBeg label comp-IDEnd auth comp-IDEnd label comp-IDAuth asym-IDLabel asym-IDAuth seq-IDLabel seq-ID
d_11GLYGLYGLYGLYAA7 - 25918 - 270
d_12SF4SF4SF4SF4AH301
d_21GLYGLYGLYGLYBB7 - 25918 - 270
d_22SF4SF4SF4SF4BL301
d_31GLYGLYGLYGLYCC7 - 25918 - 270
d_32SF4SF4SF4SF4CP301
d_41GLYGLYGLYGLYDD7 - 25918 - 270
d_42SF4SF4SF4SF4DS301
d_51GLYGLYGLYGLYEE7 - 25918 - 270
d_52SF4SF4SF4SF4EU301
d_61GLYGLYGLYGLYFF7 - 25918 - 270
d_62SF4SF4SF4SF4FW301
d_71GLYGLYGLYGLYGG7 - 25918 - 270
d_72SF4SF4SF4SF4GY301

NCS oper:
IDCodeMatrixベクター
1given(0.975662095644, -0.203125240357, -0.0826051563341), (0.202341973317, 0.688799113522, 0.696141872785), (-0.0845056267765, -0.695913728806, 0.713135948541)9.63232580667, 57.7478990509, 33.5560060856
2given(0.910913683542, -0.214403796041, -0.352515635651), (0.309822853397, -0.208794988347, 0.927585280367), (-0.272481303301, -0.954167524643, -0.123767016072)-1.71666782253, 124.985760341, 6.5191783474
3given(-0.955828849485, -0.272128779967, 0.111072668131), (-0.258159904184, 0.596613202956, -0.759872456357), (0.140515744184, -0.754982525078, -0.640512851131)21.6081048138, -12.1419428814, -32.2126215986
4given(-0.894959005678, -0.261596982655, 0.361407521812), (-0.290128963249, -0.274140798609, -0.916881675693), (0.338930026466, -0.925426302416, 0.169447915172)35.2238253151, 35.7303060055, 20.0880712921
5given(0.866208333721, -0.107259913981, -0.488035278893), (0.128919987683, -0.895650564266, 0.425663838617), (-0.482765739637, -0.431631066517, -0.76199203608)-17.0275040337, 144.7665127, -59.1827729578
6given(-0.859206107908, -0.0878281049192, 0.50403480844), (-0.126942497922, -0.917755246013, -0.376312251512), (0.495631381527, -0.387313222602, 0.777391793913)31.4742455318, 105.582209048, 15.7067999632

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要素

#1: タンパク質
NAD_synthase domain-containing protein / LarE / ATP-dependent sacrificial sulfur transferase LarE / NAD_synthase domain-containing protein


分子量: 31161.916 Da / 分子数: 7 / 由来タイプ: 組換発現
由来: (組換発現) Methanococcus maripaludis (古細菌)
遺伝子: MMP1239,larE / プラスミド: PET15B / 発現宿主: Escherichia coli BL21(DE3) (大腸菌) / 参照: UniProt: Q6LXV7
#2: 化合物
ChemComp-SF4 / IRON/SULFUR CLUSTER


分子量: 351.640 Da / 分子数: 7 / 由来タイプ: 合成 / : Fe4S4 / タイプ: SUBJECT OF INVESTIGATION
#3: 化合物 ChemComp-AMP / ADENOSINE MONOPHOSPHATE / AMP


分子量: 347.221 Da / 分子数: 1 / 由来タイプ: 天然 / : C10H14N5O7P / タイプ: SUBJECT OF INVESTIGATION / コメント: AMP*YM
#4: 化合物
ChemComp-CL / CHLORIDE ION / クロリド


分子量: 35.453 Da / 分子数: 11 / 由来タイプ: 合成 / : Cl
#5: 水 ChemComp-HOH / water


分子量: 18.015 Da / 分子数: 4 / 由来タイプ: 天然 / : H2O
研究の焦点であるリガンドがあるかY

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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: 4.73 Å3/Da / 溶媒含有率: 74.01 %
結晶化温度: 298 K / 手法: 蒸気拡散法, ハンギングドロップ法 / pH: 7.5 / 詳細: 4.1 M NaCl, 0.1 M HEPES pH 7.5, 10 % Glycerol
Temp details: Crystallization under Anaerobic conditions (Jacomex Glove Box)

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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: SOLEIL / ビームライン: PROXIMA 1 / 波長: 0.978565 Å
検出器タイプ: DECTRIS EIGER X 16M / 検出器: PIXEL / 日付: 2020年12月10日 / 詳細: U20
放射モノクロメーター: Si(111) / 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: 0.978565 Å / 相対比: 1
反射解像度: 3.19→47.87 Å / Num. obs: 64718 / % possible obs: 99.6 % / 冗長度: 7.8 % / Biso Wilson estimate: 128.14 Å2 / CC1/2: 0.996 / Rrim(I) all: 0.163 / Net I/σ(I): 7.6
反射 シェル
解像度 (Å)Mean I/σ(I) obsNum. unique obsCC1/2Rrim(I) allDiffraction-ID% possible all
9.42-47.8725.2626690.9950.077198
6.72-9.4220.5245120.9970.0871100
5.51-6.7213.1157620.990.1411100
4.78-5.5111.4267530.9880.1591100
4.28-4.789.5776210.9860.1941100
3.91-4.286.1683850.970.31100
3.62-3.913.3690980.8950.5541100
3.39-3.621.6997520.7041.071100
3.19-3.390.77101660.3542.1198.2

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解析

ソフトウェア
名称バージョン分類
MxCuBEDec, 2020データ収集
XDSDec, 2020データ削減
XDSDec, 2020データスケーリング
PHENIXJan 31, 2020位相決定
PHENIXJan 31, 2020モデル構築
PHENIX1.20.1-4487精密化
精密化構造決定の手法: 分子置換 / 解像度: 3.19→47.87 Å / SU ML: 0.5096 / 交差検証法: FREE R-VALUE / σ(F): 1.34 / 位相誤差: 28.821
立体化学のターゲット値: GeoStd + Monomer Library + CDL v1.2
Rfactor反射数%反射
Rfree0.2525 3230 5 %
Rwork0.2164 61363 -
obs0.2182 64593 99.53 %
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: 140.55 Å2
精密化ステップサイクル: LAST / 解像度: 3.19→47.87 Å
タンパク質核酸リガンド溶媒全体
原子数14441 0 90 4 14535
拘束条件
Refine-IDタイプDev ideal
X-RAY DIFFRACTIONf_bond_d0.013514747
X-RAY DIFFRACTIONf_angle_d1.463319866
X-RAY DIFFRACTIONf_chiral_restr0.10272280
X-RAY DIFFRACTIONf_plane_restr0.01112508
X-RAY DIFFRACTIONf_dihedral_angle_d5.7321919
Refine LS restraints NCS
Ens-IDDom-IDAuth asym-IDRefine-IDタイプRms dev position (Å)
ens_1d_2AX-RAY DIFFRACTIONTorsion NCS1.19776922246
ens_1d_3AX-RAY DIFFRACTIONTorsion NCS1.24088096227
ens_1d_4AX-RAY DIFFRACTIONTorsion NCS1.0072309169
ens_1d_5AX-RAY DIFFRACTIONTorsion NCS1.16396048401
ens_1d_6AX-RAY DIFFRACTIONTorsion NCS1.06361828998
ens_1d_7AX-RAY DIFFRACTIONTorsion NCS1.0785459414
LS精密化 シェル
解像度 (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
3.19-3.240.41331280.42822392X-RAY DIFFRACTION90.88
3.24-3.290.43981410.41052671X-RAY DIFFRACTION99.75
3.29-3.350.38011390.36352649X-RAY DIFFRACTION99.96
3.35-3.40.34421390.33542628X-RAY DIFFRACTION99.93
3.4-3.460.34531400.31942667X-RAY DIFFRACTION99.96
3.46-3.530.33011390.31842650X-RAY DIFFRACTION100
3.53-3.60.37121400.32432656X-RAY DIFFRACTION99.96
3.6-3.680.3721410.32772665X-RAY DIFFRACTION100
3.68-3.770.38381390.30092641X-RAY DIFFRACTION99.96
3.77-3.860.3331410.282681X-RAY DIFFRACTION100
3.86-3.970.26711400.24132673X-RAY DIFFRACTION100
3.97-4.080.24941390.22822634X-RAY DIFFRACTION99.93
4.08-4.210.23811410.22272683X-RAY DIFFRACTION100
4.21-4.360.28931410.21782675X-RAY DIFFRACTION100
4.36-4.540.26831410.22062677X-RAY DIFFRACTION99.86
4.54-4.750.21731410.18522677X-RAY DIFFRACTION100
4.75-50.2321410.1912670X-RAY DIFFRACTION100
5-5.310.25491410.2012687X-RAY DIFFRACTION100
5.31-5.720.23821410.19342685X-RAY DIFFRACTION100
5.72-6.290.24681430.20932717X-RAY DIFFRACTION100
6.29-7.20.24891440.2142723X-RAY DIFFRACTION100
7.2-9.060.18871440.16482742X-RAY DIFFRACTION99.97
9.06-47.870.1961460.1682820X-RAY DIFFRACTION98.93
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)
12.7246071908-0.1561362329781.226413181183.627633980140.4357878049982.463831353690.401264985445-0.229961147968-0.6250967387980.2627569520010.248864050321-0.4999261825050.5123408233870.801167548184-0.0001846841127791.30788735460.291950335714-0.2438696502741.44973775349-0.349665272391.3783029475739.225.318-44.409
20.833271859424-0.0179654211632-0.1310797992570.1332220223210.03174825044610.0226167764806-0.513196153172-0.5058716638220.6931132972470.4228942067610.862302185991.78233304603-1.07610582036-1.21680078927-0.01954617309881.510949107170.05301328769980.01105896721851.303619700170.008911136813071.8921851889217.17140.484-43.56
34.985809793660.321069315856-1.408781900141.026190672861.351409600061.698414089930.4679711860431.02601583347-0.0474606958788-0.1542142200420.128696461235-0.06762177944670.04756612618210.533369283515-0.01165160062131.370841725990.347839991986-0.2241109683621.64470706475-0.2529933856591.3614131820933.6428.978-51.163
44.94475417765-0.2237692358850.258087857380.9746430719570.5609898463333.490925424040.527165971059-0.742685823885-1.036942985940.6174627421160.396738095604-0.3123448349651.305794341950.2792334084750.007646728929891.76518597230.0854029751775-0.4456098116460.9364789515360.04472598206891.254461583037.3218.666-42.961
52.86237849241-1.008191582592.567889063124.09699495833-0.486727706122.254191211740.1025932350890.654286395732-0.2503871860590.5674421710230.2101785119-1.367132130450.1319383227450.3892088293230.0009009273411651.16934473253-0.0252371514667-0.09536752512021.28039587441-0.2527396197441.6392514654646.06152.317-18.703
60.435591010988-0.0563704760969-0.05036025258280.359899766186-0.3322446657250.20046887551-0.2645058478271.630984287140.697108072417-0.9689590293880.03598152224710.543301783454-0.619287676441-1.002612162390.001236206570641.37722290889-0.05322612231090.07614188695511.811780765140.2482323999131.5435210068222.0958.369-27.328
71.816550751751.027126029561.976690196612.19475367686-0.149158377081.99831087690.1557888827880.888316339877-0.273672661613-0.1867409586960.179580134713-0.7453748122370.2183258620470.5242672206180.01906441024021.23232455320.03100410908420.0762634716241.46167996657-0.2589305507461.4692904260240.5848.949-26.104
84.326655900631.291932819070.04971386234043.282992197920.1965606271314.39940446240.220909466474-1.17283590486-0.183907416211.037111351770.0761611920605-0.4768953398050.438798428144-0.1153514505-0.01882295129281.42789800206-0.193331653673-0.09733864788511.211237986630.04685009036950.93736545632216.92842.347-10.57
92.48877005880.6411437518471.0269890962.479924231631.751601884782.30840203726-0.404546485289-0.02814975280811.119432359950.393898310276-0.0437116288263-0.20874394459-0.6971496499950.7957148870860.002154191236861.41499778952-0.263614023365-0.4415434606121.278296204050.4219300201131.5388115567644.24390.514-21.961
100.3706437929740.2296937975940.4929156452840.2880183861660.2623348361340.541299220347-1.230012759461.92175286141.0170763696-1.35735499913-0.7448030681930.04458842544330.893250340996-1.751045226860.006365085790891.39138892698-0.315334170721-0.3670079565371.91393271787-0.05450544333861.9572229742620.86381.375-31.47
114.973820651461.45896518389-1.379575063333.521041293980.4356222815221.34050075102-0.6546801735530.3649277391930.264202925474-0.0474287763570.2228927577410.2064713259490.1329709555580.267624897855-0.01575165904271.28482749238-0.137861342593-0.2595900689991.239468198840.2650613833941.3434177656340.76281.533-24.131
123.068090942120.928135581787-1.879810582492.5878852272-0.7874894068911.35760638049-0.416555774673-0.934176400341.560144902210.66378684876-0.345356316931-0.200025554224-0.609864308381-0.1454543227310.00193371079451.536712695060.0557039720948-0.3677794263991.19165613543-0.2921911843241.5496464049516.64183.775-8.301
131.434781920061.43181923794-1.571635189913.77307789944-1.115085578474.03321936387-0.3954909257140.268664425252-0.1255359525030.03574202170220.4325894662550.1670263356410.507515524355-0.474904683512-0.0149433179961.27278825071-0.336790526304-0.02003319158951.735480099130.3949338211761.19058898038-25.02530.084-20.164
141.82409825667-0.195725938516-1.237760361251.95943053742-0.5500904648251.56321660991-0.284622246877-0.4537005854110.1610872704250.140090969390.4427875665250.300257705236-0.189043734489-0.419226777042-0.03526404702961.34581605565-0.3202688353890.02683950497591.867721291540.2995040619771.31873213872-24.1534.783-12.253
155.31702691967-1.315011154470.7133761563252.368765199620.537527689191.986457047830.365708610877-0.420204973969-0.7856118155590.52606569033-0.0869201217634-0.1850434869011.27542089709-0.5844101263280.005832439822621.50645757948-0.32241294019-0.1087190177371.066299583340.1933097253341.06791391144.20529.631-17.774
160.0456933539863-0.2016116474120.2772029458420.5778498757080.0822558852030.68931213553-0.80160533237-2.11259987804-0.1718208847761.132021861970.9542682239641.25207472611-0.7309913703750.5097978186480.0024569917171.740346725090.3010738374250.4632890560933.63954095260.006067556203981.66101416386-30.85263.0773.32
170.423356079151-0.6267222083750.0008374886304862.045934965791.793256473691.43048090256-0.02890250972180.531279561382-0.6841521297011.61565412558-0.2540831845040.0336596629187-0.286246734059-2.3557944905-0.00297448735471.679483921740.02272741627840.3146548552182.344165006590.1271703901211.26306123176-17.49154.8931.862
180.6916855311440.0970528148205-0.1349811628620.0187859477477-0.006416195301780.815629395661-0.788469317599-0.338467892130.883469794473-1.918695430960.791722468928-0.03978763539770.596392593303-0.5951884137990.008558044881521.35765845693-0.2679405420720.05161213748461.72728218914-0.2311586012031.51572253707-6.7859.693-18.953
190.7697901007660.3220717496520.9267513854380.0957857050426-0.02281077829251.12485464805-0.673193400141-1.110749848160.309071424148-1.069517808440.3765037110761.201847534020.500546434679-0.663542303851-0.007727074595321.4207689171-0.1859811320990.101985166721.929195783340.1788920903331.155761851-19.6657.125-13.478
202.57438045116-0.8230995579741.891077807270.735899391866-0.4537047067152.61430396378-0.867369443218-2.740665818321.193880214160.6068728067030.3390265203061.31641130498-0.386170242014-1.38734443667-0.0006222303586111.346323812370.3667972879970.104593190662.40257833415-0.4567136307911.7593860662-24.15268.328-6.448
21-0.02327980268190.0221438894543-0.01943049689280.716126488235-0.2193486966220.1029020221-0.0713416142810.8561990754140.2787639646291.23958067792-0.9155619681051.09224682903-1.28680039585-2.04741540897-0.1079669024932.098855101260.2992120616490.4034413235682.27289992906-0.4578998809881.62120198897-17.12467.5279.462
223.029495316340.8471832135041.895792308843.85617768357-0.7151799933212.13877993862-0.178707773769-1.213105877290.05978801515451.15704099178-0.160905132909-0.07344678952690.116730311544-0.0983759270853-0.03126584320831.442181856970.0129484057245-0.003641705310711.54260054545-0.1300357842831.061988542087.84767.618-1.92
231.996522021712.084098733331.715755783573.445885829990.4052627744253.18130379198-0.03664178439820.385153233870.921933765597-0.58419466759-0.1084305925220.624034544733-0.6378660409150.688879395010.0004486300836451.67055163654-0.570495305367-0.7190412011861.671118201570.8213778487182.0608413327135.714108.261-55.535
240.100672163997-0.122121729961-0.01699255869840.8147958406380.5295571099210.298793902017-2.38916289111.441680643180.595151633364-0.811933749506-0.2333345129120.7954182217310.0924072446223-1.189040168390.01669193809151.62558234035-0.491288342513-0.3375551241681.74711530280.2615667908912.0427923752514.87391.991-51.88
252.154291706691.67820240663-0.04689110689961.100126374780.3548994945620.149596153402-0.6419902602970.758832445324-0.1027975845970.435496225918-0.4483509166-0.259749266866-0.3727684319840.392675970386-0.01658902035481.70797999561-0.439860104903-0.685107745081.552829572470.8417314017972.0100768249832.31796.365-53.723
260.09120695759970.295231792710.1715141942391.082208489891.036593086651.34618654598-1.39459693740.6483558200320.7070475758730.72123538463-1.576950283931.014271964570.193878314140.106769620098-0.2641582208511.57462052367-0.192196730184-1.146541521.645381313041.060992994181.9395981329336.40896.778-45.555
270.2786621214060.305430958367-0.4527853655820.308033058255-0.3631950087420.400334576577-0.7213736315091.992166754821.52836045907-0.2051809962330.3676663048940.126589446353-0.5215989931080.7936291917880.02798849343071.74414120133-0.539997052458-0.5964176185741.838072229730.5288083615082.1313279292535.192114.929-44.408
280.975648569336-0.872180655141-1.421693964111.231917700021.100689118431.8180648718-0.5899373223240.3955458622120.77624081614-0.0911064962037-0.641673390669-0.743551464352-1.58854455947-0.06359337948280.03600337139212.02937803791-0.231866779505-1.181599690951.024891165940.2300584751792.1662325356610.198108.029-42.045
290.5912575158570.0242418563442-1.125164110180.0795595517403-0.6899887802582.9660650371-0.445476365169-0.03760512017061.195020052280.2868745893430.002972548232571.11690207906-1.458731750450.678463096834-0.05599461889452.01378764186-0.0135921627317-1.055844874080.796351432325-0.06930998857242.633600405436.014113.783-33.427
300.5331418705780.276379883706-0.4657752238460.201837813239-0.2756279931150.430064643545-0.791442230344-0.5340380716050.1247735519220.4846918622620.745646367066-0.192865259789-0.15842104528-0.1530065620760.0003181654349141.792761225570.710495055636-0.3940833305642.32798843042-1.0182620462.08140121847-36.395.844-11.704
310.281942187171-0.2128228271240.1897006518310.115970443556-0.04550157380881.41534894055-0.773864960663-0.505953907034-0.7673685473971.016136200250.204473822830.536260497903-1.903796259470.0124429182118-0.0365806457122.19436472641.13441319201-0.4844029200661.79850358952-0.5197327892541.93931932094-30.22397.311-8.709
320.945856275714-0.3495012111660.434257149851.39662770915-1.568127379551.383865518280.374602166432-0.3780166496890.6059199203141.62377971976-0.06103660177980.407207847053-1.566551704260.111922736131-0.000695161967382.058132368680.398989225078-0.2166563243812.07031641043-0.7865980362382.00665828766-18.76191.33-6.882
331.376744171530.8461341958470.6593246274280.9358659750250.2312008761050.27728226041-0.4758556657570.38570557789-0.5641184932340.159295625928-0.1216267772640.499664984214-0.389532624798-1.00613013316-0.002956094092121.490836669670.261367404181-0.1461167242471.5858037253-0.7112437966532.32473288307-16.63882.457-21.63
341.517285031380.136802805933-1.150997303170.7771004531290.162515460241.09095437647-0.378207590206-0.7706169705040.213424904890.2889652022350.1669206061140.546614031665-0.696620421514-0.07519770075330.004734077534931.89863510130.592844712659-0.4939075534582.08157774546-0.8016745159051.8860416279-29.46997.153-20.132
350.2368637189870.079332783931-0.420563082130.5618515581030.004103511741310.269883015283-0.71574908761-0.490515030767-0.1359459662590.860328311165-0.07299642730180.567293945876-0.780753887358-0.532438878477-0.004311846421891.709259905950.399214819789-0.4332858422341.89502489606-0.5116483044682.01784292886-11.22698.004-17.918
360.226978530849-0.01110848684670.136789682610.539711166031-0.08889396346450.251099768621-0.870776698861-0.8876107000170.8683667921140.000439373967941-0.2684727813881.26672065366-0.733075068609-0.62780012970.00829965155751.786015613680.226639661436-0.9023623640661.25099194921-0.5516936530332.2085360433-0.33101.478-17.503
371.44127003330.372030365487-0.850566094940.946379582872-1.685360234512.21759378318-0.662448190679-0.8377771079480.845373102055-0.03966818558310.04275565541090.536004622013-1.208821271320.819863822903-0.003657460441741.875922230440.0819208277064-0.9860492532191.0933357281-0.4417884635892.212120846764.79107.324-22.957
精密化 TLSグループ
IDRefine-IDRefine TLS-IDSelection detailsAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1( CHAIN A AND RESID 5:80 )A5 - 80
2X-RAY DIFFRACTION2( CHAIN A AND RESID 81:94 )A81 - 94
3X-RAY DIFFRACTION3( CHAIN A AND RESID 95:175 )A95 - 175
4X-RAY DIFFRACTION4( CHAIN A AND RESID 176:259 )A176 - 259
5X-RAY DIFFRACTION5( CHAIN B AND RESID 6:80 )B6 - 80
6X-RAY DIFFRACTION6( CHAIN B AND RESID 81:94 )B81 - 94
7X-RAY DIFFRACTION7( CHAIN B AND RESID 95:175 )B95 - 175
8X-RAY DIFFRACTION8( CHAIN B AND RESID 176:259 )B176 - 259
9X-RAY DIFFRACTION9( CHAIN C AND RESID 4:80 )C4 - 80
10X-RAY DIFFRACTION10( CHAIN C AND RESID 81:94 )C81 - 94
11X-RAY DIFFRACTION11( CHAIN C AND RESID 95:174 )C95 - 174
12X-RAY DIFFRACTION12( CHAIN C AND RESID 175:259 )C175 - 259
13X-RAY DIFFRACTION13( CHAIN D AND RESID -1:114 )D-1 - 114
14X-RAY DIFFRACTION14( CHAIN D AND RESID 115:174 )D115 - 174
15X-RAY DIFFRACTION15( CHAIN D AND RESID 175:259 )D175 - 259
16X-RAY DIFFRACTION16( CHAIN E AND RESID 7:31 )E7 - 31
17X-RAY DIFFRACTION17( CHAIN E AND RESID 32:80 )E32 - 80
18X-RAY DIFFRACTION18( CHAIN E AND RESID 81:94 )E81 - 94
19X-RAY DIFFRACTION19( CHAIN E AND RESID 95:114 )E95 - 114
20X-RAY DIFFRACTION20( CHAIN E AND RESID 115:153 )E115 - 153
21X-RAY DIFFRACTION21( CHAIN E AND RESID 154:174 )E154 - 174
22X-RAY DIFFRACTION22( CHAIN E AND RESID 175:259 )E175 - 259
23X-RAY DIFFRACTION23( CHAIN F AND RESID 7:80 )F7 - 80
24X-RAY DIFFRACTION24( CHAIN F AND RESID 81:94 )F81 - 94
25X-RAY DIFFRACTION25( CHAIN F AND RESID 95:129 )F95 - 129
26X-RAY DIFFRACTION26( CHAIN F AND RESID 130:153 )F130 - 153
27X-RAY DIFFRACTION27( CHAIN F AND RESID 154:174 )F154 - 174
28X-RAY DIFFRACTION28( CHAIN F AND RESID 175:221 )F175 - 221
29X-RAY DIFFRACTION29( CHAIN F AND RESID 222:259 )F222 - 259
30X-RAY DIFFRACTION30( CHAIN G AND RESID 7:31 )G7 - 31
31X-RAY DIFFRACTION31( CHAIN G AND RESID 32:44 )G32 - 44
32X-RAY DIFFRACTION32( CHAIN G AND RESID 45:80 )G45 - 80
33X-RAY DIFFRACTION33( CHAIN G AND RESID 81:114 )G81 - 114
34X-RAY DIFFRACTION34( CHAIN G AND RESID 115:164 )G115 - 164
35X-RAY DIFFRACTION35( CHAIN G AND RESID 165:185 )G165 - 185
36X-RAY DIFFRACTION36( CHAIN G AND RESID 186:214 )G186 - 214
37X-RAY DIFFRACTION37( CHAIN G AND RESID 215:259 )G215 - 259

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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