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- PDB-6puj: Structure of human MAIT A-F7 TCR in complex with human MR1-3`OH-P... -

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基本情報

登録情報
データベース: PDB / ID: 6puj
タイトルStructure of human MAIT A-F7 TCR in complex with human MR1-3`OH-Propyl-5-OP-U
要素
  • Beta-2-microglobulin
  • Human TCR alpha chain
  • Human TCR beta chain
  • Major histocompatibility complex class I-related gene protein
キーワードIMMUNE SYSTEM / MAIT / MR1 / Metablite presentation
機能・相同性
機能・相同性情報


positive regulation of T cell mediated cytotoxicity directed against tumor cell target / antigen processing and presentation of exogenous antigen / MHC class I receptor activity / beta-2-microglobulin binding / antigen processing and presentation of peptide antigen via MHC class I / T cell receptor binding / early endosome lumen / Nef mediated downregulation of MHC class I complex cell surface expression / DAP12 interactions / Endosomal/Vacuolar pathway ...positive regulation of T cell mediated cytotoxicity directed against tumor cell target / antigen processing and presentation of exogenous antigen / MHC class I receptor activity / beta-2-microglobulin binding / antigen processing and presentation of peptide antigen via MHC class I / T cell receptor binding / early endosome lumen / Nef mediated downregulation of MHC class I complex cell surface expression / DAP12 interactions / Endosomal/Vacuolar pathway / T cell mediated cytotoxicity / Antigen Presentation: Folding, assembly and peptide loading of class I MHC / regulation of iron ion transport / cellular response to iron(III) ion / negative regulation of iron ion transport / negative regulation of forebrain neuron differentiation / antigen processing and presentation of exogenous protein antigen via MHC class Ib, TAP-dependent / ER to Golgi transport vesicle membrane / peptide antigen assembly with MHC class I protein complex / regulation of erythrocyte differentiation / response to molecule of bacterial origin / HFE-transferrin receptor complex / transferrin transport / MHC class I peptide loading complex / cellular response to iron ion / negative regulation of receptor-mediated endocytosis / positive regulation of T cell cytokine production / antigen processing and presentation of endogenous peptide antigen via MHC class I / MHC class I protein complex / peptide antigen assembly with MHC class II protein complex / negative regulation of neurogenesis / cellular response to nicotine / MHC class II protein complex / positive regulation of receptor-mediated endocytosis / multicellular organismal-level iron ion homeostasis / positive regulation of T cell mediated cytotoxicity / specific granule lumen / positive regulation of immune response / antigen processing and presentation of exogenous peptide antigen via MHC class II / peptide antigen binding / phagocytic vesicle membrane / recycling endosome membrane / positive regulation of T cell activation / negative regulation of epithelial cell proliferation / Interferon gamma signaling / Immunoregulatory interactions between a Lymphoid and a non-Lymphoid cell / Modulation by Mtb of host immune system / positive regulation of cellular senescence / sensory perception of smell / tertiary granule lumen / MHC class II protein complex binding / DAP12 signaling / T cell differentiation in thymus / late endosome membrane / negative regulation of neuron projection development / ER-Phagosome pathway / protein refolding / early endosome membrane / amyloid fibril formation / protein homotetramerization / defense response to Gram-negative bacterium / intracellular iron ion homeostasis / learning or memory / defense response to Gram-positive bacterium / immune response / endoplasmic reticulum lumen / Amyloid fiber formation / Golgi membrane / external side of plasma membrane / innate immune response / lysosomal membrane / focal adhesion / Neutrophil degranulation / endoplasmic reticulum membrane / SARS-CoV-2 activates/modulates innate and adaptive immune responses / structural molecule activity / endoplasmic reticulum / Golgi apparatus / protein homodimerization activity / : / extracellular exosome / extracellular region / membrane / identical protein binding / plasma membrane / cytosol
類似検索 - 分子機能
MHC class I-like antigen recognition-like / Murine Class I Major Histocompatibility Complex, H2-DB; Chain A, domain 1 / MHC class I alpha chain, alpha1 alpha2 domains / Class I Histocompatibility antigen, domains alpha 1 and 2 / Beta-2-Microglobulin / : / MHC class I-like antigen recognition-like / MHC class I-like antigen recognition-like superfamily / MHC classes I/II-like antigen recognition protein / : ...MHC class I-like antigen recognition-like / Murine Class I Major Histocompatibility Complex, H2-DB; Chain A, domain 1 / MHC class I alpha chain, alpha1 alpha2 domains / Class I Histocompatibility antigen, domains alpha 1 and 2 / Beta-2-Microglobulin / : / MHC class I-like antigen recognition-like / MHC class I-like antigen recognition-like superfamily / MHC classes I/II-like antigen recognition protein / : / Immunoglobulin/major histocompatibility complex, conserved site / Immunoglobulins and major histocompatibility complex proteins signature. / Immunoglobulin C-Type / Immunoglobulin C1-set / Immunoglobulin C1-set domain / Ig-like domain profile. / Immunoglobulin-like domain / Immunoglobulin-like domain superfamily / Immunoglobulin-like fold / Immunoglobulins / Immunoglobulin-like / Sandwich / 2-Layer Sandwich / Mainly Beta / Alpha Beta
類似検索 - ドメイン・相同性
Chem-Q7S / Beta-2-microglobulin / Major histocompatibility complex class I-related protein 1
類似検索 - 構成要素
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: 1.92 Å
データ登録者Awad, W. / Keller, A.N. / Rossjohn, J.
資金援助 オーストラリア, 1件
組織認可番号国
Australian Research Council (ARC) オーストラリア
引用ジャーナル: Nat.Immunol. / 年: 2020
タイトル: The molecular basis underpinning the potency and specificity of MAIT cell antigens.
著者: Awad, W. / Ler, G.J.M. / Xu, W. / Keller, A.N. / Mak, J.Y.W. / Lim, X.Y. / Liu, L. / Eckle, S.B.G. / Le Nours, J. / McCluskey, J. / Corbett, A.J. / Fairlie, D.P. / Rossjohn, J.
履歴
登録2019年7月18日登録サイト: RCSB / 処理サイト: RCSB
改定 1.02020年2月19日Provider: repository / タイプ: Initial release
改定 1.12020年3月11日Group: Database references / カテゴリ: citation / citation_author
Item: _citation.country / _citation.journal_abbrev ..._citation.country / _citation.journal_abbrev / _citation.journal_id_CSD / _citation.journal_id_ISSN / _citation.pdbx_database_id_DOI / _citation.year
改定 1.22020年3月18日Group: Database references / カテゴリ: citation / Item: _citation.pdbx_database_id_PubMed / _citation.title
改定 1.32020年4月1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_author.identifier_ORCID
改定 1.42023年10月11日Group: Data collection / Database references ...Data collection / Database references / Derived calculations / Refinement description
カテゴリ: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model / pdbx_struct_conn_angle / struct_conn
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _pdbx_struct_conn_angle.ptnr1_auth_seq_id / _pdbx_struct_conn_angle.ptnr3_auth_seq_id / _pdbx_struct_conn_angle.value / _struct_conn.pdbx_dist_value / _struct_conn.ptnr1_auth_asym_id / _struct_conn.ptnr1_auth_comp_id / _struct_conn.ptnr1_auth_seq_id / _struct_conn.ptnr1_label_asym_id / _struct_conn.ptnr1_label_atom_id / _struct_conn.ptnr1_label_comp_id / _struct_conn.ptnr1_label_seq_id / _struct_conn.ptnr2_auth_asym_id / _struct_conn.ptnr2_auth_comp_id / _struct_conn.ptnr2_auth_seq_id / _struct_conn.ptnr2_label_asym_id / _struct_conn.ptnr2_label_atom_id / _struct_conn.ptnr2_label_comp_id
改定 1.52024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
A: Major histocompatibility complex class I-related gene protein
B: Human TCR alpha chain
C: Major histocompatibility complex class I-related gene protein
D: Human TCR alpha chain
E: Human TCR beta chain
F: Beta-2-microglobulin
G: Human TCR beta chain
H: Beta-2-microglobulin
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)188,81815
ポリマ－188,1008
非ポリマー7177
水28,1211561
1
A: Major histocompatibility complex class I-related gene protein
B: Human TCR alpha chain
G: Human TCR beta chain
H: Beta-2-microglobulin
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)94,4558
ポリマ－94,0504
非ポリマー4054
水724
タイプ名称対称操作数
identity operation1_555x,y,z1
Buried area9010 Å2
ΔGint-61 kcal/mol
Surface area36750 Å2
手法PISA
2
C: Major histocompatibility complex class I-related gene protein
D: Human TCR alpha chain
E: Human TCR beta chain
F: Beta-2-microglobulin
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)94,3637
ポリマ－94,0504
非ポリマー3133
水724
タイプ名称対称操作数
identity operation1_555x,y,z1
Buried area8870 Å2
ΔGint-61 kcal/mol
Surface area36090 Å2
手法PISA
単位格子
Length a, b, c (Å)218.607, 70.776, 143.802
Angle α, β, γ (deg.)90.000, 104.562, 90.000
Int Tables number5
Space group name H-MC121
Space group name HallC2y
Symmetry operation#1: x,y,z
#2: -x,y,-z
#3: x+1/2,y+1/2,z
#4: -x+1/2,y+1/2,-z

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要素

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タンパク質 , 4種, 8分子 ACBDEGFH

#1: タンパク質 Major histocompatibility complex class I-related gene protein / MHC class I-related gene protein / Class I histocompatibility antigen-like protein


分子量: 31711.670 Da / 分子数: 2 / 由来タイプ: 組換発現 / 由来: (組換発現) Homo sapiens (ヒト) / 遺伝子: MR1 / 発現宿主: Escherichia coli (大腸菌) / 参照: UniProt: Q95460
#2: タンパク質 Human TCR alpha chain


分子量: 22781.268 Da / 分子数: 2 / 由来タイプ: 組換発現 / 由来: (組換発現) Homo sapiens (ヒト) / 遺伝子: TRA@ / 発現宿主: Escherichia coli (大腸菌)
#3: タンパク質 Human TCR beta chain


分子量: 27677.760 Da / 分子数: 2 / 由来タイプ: 組換発現 / 由来: (組換発現) Homo sapiens (ヒト) / 発現宿主: Escherichia coli (大腸菌)
#4: タンパク質 Beta-2-microglobulin


分子量: 11879.356 Da / 分子数: 2 / 由来タイプ: 組換発現 / 由来: (組換発現) Homo sapiens (ヒト) / 遺伝子: B2M, CDABP0092, HDCMA22P / 発現宿主: Escherichia coli (大腸菌) / 参照: UniProt: P61769*PLUS

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非ポリマー , 5種, 1568分子

#5: 化合物 ChemComp-GOL / GLYCEROL / GLYCERIN / PROPANE-1,2,3-TRIOL


分子量: 92.094 Da / 分子数: 1 / 由来タイプ: 合成 / 式: C3H8O3
#6: 化合物 ChemComp-CL / CHLORIDE ION


分子量: 35.453 Da / 分子数: 2 / 由来タイプ: 合成 / 式: Cl
#7: 化合物 ChemComp-Q7S / 6-[(3-hydroxypropyl)amino]-5-[(E)-(2-oxopropylidene)amino]pyrimidine-2,4(1H,3H)-dione


分子量: 254.243 Da / 分子数: 2 / 由来タイプ: 合成 / 式: C10H14N4O4 / タイプ: SUBJECT OF INVESTIGATION
#8: 化合物 ChemComp-NA / SODIUM ION


分子量: 22.990 Da / 分子数: 2 / 由来タイプ: 合成 / 式: Na
#9: 水 ChemComp-HOH / water


分子量: 18.015 Da / 分子数: 1561 / 由来タイプ: 天然 / 式: H2O

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詳細

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: 2.86 Å3/Da / 溶媒含有率: 57.03 %
結晶化温度: 293 K / 手法: 蒸気拡散法, ハンギングドロップ法
詳細: 100 mM BTP (pH 6.0 - 6.5), 8-20% PEG3350 and 200 mM sodium acetate

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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: Australian Synchrotron / ビームライン: MX2 / 波長: 0.953736 Å
検出器タイプ: DECTRIS EIGER X 16M / 検出器: PIXEL / 日付: 2017年7月11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: 0.953736 Å / 相対比: 1
反射解像度: 1.92→45.77 Å / Num. obs: 162028 / % possible obs: 99.63 % / 冗長度: 3.5 % / Biso Wilson estimate: 36.68 Å2 / CC1/2: 0.999 / Net I/σ(I): 15.88
反射 シェル解像度: 1.92→1.99 Å / Num. unique obs: 16074 / CC1/2: 0.781

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解析

ソフトウェア
名称バージョン分類
PHENIX1.16_3549精密化
XDS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: 4L4T

4l4t


解像度: 1.92→45.77 Å / SU ML: 0.2013 / 交差検証法: FREE R-VALUE / σ(F): 1.34 / 位相誤差: 21.1125
Rfactor反射数%反射
Rfree0.1936 8143 5.03 %
Rwork0.1625 --
obs0.1641 161946 99.64 %
溶媒の処理減衰半径: 0.9 Å / VDWプローブ半径: 1.11 Å
原子変位パラメータBiso mean: 48.62 Å2
精密化ステップサイクル: LAST / 解像度: 1.92→45.77 Å
タンパク質核酸リガンド溶媒全体
原子数12756 0 44 1561 14361
拘束条件
Refine-IDタイプDev ideal数
X-RAY DIFFRACTIONf_bond_d0.004913827
X-RAY DIFFRACTIONf_angle_d0.72318960
X-RAY DIFFRACTIONf_chiral_restr0.05042027
X-RAY DIFFRACTIONf_plane_restr0.00432506
X-RAY DIFFRACTIONf_dihedral_angle_d16.64338453
LS精密化 シェル
解像度 (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
1.92-1.940.30513120.27885053X-RAY DIFFRACTION99.59
1.94-1.960.27712660.27145095X-RAY DIFFRACTION99.63
1.96-1.990.24372300.24435104X-RAY DIFFRACTION99.55
1.99-2.010.27532590.23565140X-RAY DIFFRACTION99.76
2.01-2.040.27092870.22435062X-RAY DIFFRACTION99.79
2.04-2.070.24072740.2145099X-RAY DIFFRACTION99.89
2.07-2.10.21152650.19985112X-RAY DIFFRACTION99.81
2.1-2.130.25042780.19785149X-RAY DIFFRACTION99.85
2.13-2.160.23992470.20115094X-RAY DIFFRACTION99.96
2.16-2.20.23212690.19115132X-RAY DIFFRACTION99.89
2.2-2.240.22292830.18495094X-RAY DIFFRACTION99.85
2.24-2.280.22722540.1855148X-RAY DIFFRACTION99.8
2.28-2.320.21382580.18625119X-RAY DIFFRACTION99.76
2.32-2.370.23172450.18845160X-RAY DIFFRACTION99.91
2.37-2.420.2152730.1785093X-RAY DIFFRACTION99.8
2.42-2.480.22763010.17755066X-RAY DIFFRACTION99.8
2.48-2.540.22932800.17985134X-RAY DIFFRACTION99.85
2.54-2.610.2122400.1795178X-RAY DIFFRACTION99.89
2.61-2.680.22322810.1815106X-RAY DIFFRACTION99.8
2.68-2.770.22342690.18485148X-RAY DIFFRACTION99.72
2.77-2.870.22522710.18745134X-RAY DIFFRACTION99.78
2.87-2.980.22032760.17815121X-RAY DIFFRACTION99.85
2.98-3.120.22032710.1685144X-RAY DIFFRACTION99.72
3.12-3.280.16882610.1595134X-RAY DIFFRACTION99.32
3.28-3.490.19393080.15825080X-RAY DIFFRACTION99.1
3.49-3.760.18712480.14195134X-RAY DIFFRACTION99.08
3.76-4.140.16062870.1355160X-RAY DIFFRACTION99.38
4.14-4.730.13432880.11415164X-RAY DIFFRACTION99.53
4.73-5.960.15762770.13025164X-RAY DIFFRACTION99.11
5.96-46.410.18872850.17015282X-RAY DIFFRACTION98.65
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)
11.01161883931-0.0201652602434-0.2255576621940.770522450239-0.6324325292920.862332345464-0.00922926262527-0.08264321401390.1664023961050.07712301338750.08720706862370.04264441945740.0437700423854-0.1929840657948.44094586188E-60.2395257860040.00352264813286-0.03079619308690.3357924002070.01372263209670.371939314502-48.731894328744.1047815696192.746356633
20.8260602916970.150219922841-0.1227188636130.452676011603-0.3447106857860.429532841810.02239976776870.1070302515570.162634219604-0.07107926852880.00755047477213-0.1181008382380.0595815867392-0.03845594013655.17056557518E-60.290504897155-0.0170614745421-0.0112926297820.2873400085970.01467835698970.449213461092-36.47115434147.6843778088182.286834104
30.03194786798480.1214609992420.003415602192570.3003500671470.02027603569730.1117114160450.1503612421750.0272969465549-0.182358217147-0.03011596395580.0873208954409-0.0148787808160.284391716418-0.1553107314370.0004281077755940.300412209567-0.0966846937365-0.07207792416120.3856786330080.05939525596910.335168583348-54.506236525130.2788502061180.359656997
40.525436613156-0.211791995984-0.1707322477340.9091983108720.553875102570.3128898782670.001342479240640.1285724263190.25644210053-0.314180999821-0.05816832909550.0358495452983-0.2047968705170.00278420173065.5747600271E-60.399160480812-0.104283714119-0.1005087624880.6732102956290.2159753959950.483414117732-68.157687861947.2021797552160.778485547
50.504848250076-0.619827408460.5772955210930.621394006544-0.5553456390470.594343335901-0.0366394010685-0.01304115278330.0374589973458-0.03070569899850.01746036756220.001690316576970.0318359248491-0.0107015513474-0.0001962867709660.3095351386220.02021864275630.003657531015550.215677550061-0.03190798788420.323331666071-18.945997775123.4028415046195.690008712
61.41365160905-0.676147248733-0.2300294533970.8716913871610.9035181290071.23322300681-0.07279437189880.155531639272-0.1713501952850.179468810998-0.05385045822350.04153249304470.118034475706-0.103712704913-0.0005087643862170.381034973906-0.00311491737080.04908123126310.205342345738-0.0183344653940.3521547016790.6225971208059.57161569863217.037340758
70.2183738407980.0270862024935-0.1237264921680.6297433493960.1010933739120.988721497363-0.0109840396496-0.2234420843870.01641385730890.0297865221884-0.0817634909621-0.137631621992-0.128817226034-0.0135763802152-3.17992617557E-60.3851521516780.01468245977490.009615014095530.464091802450.06077979884330.3447189226625.8052364227229.605078131255.845361371
80.413100008961-0.415164701821-0.3496827748690.8094964214780.495273116460.483955273381-0.0151688778128-0.0738866645021-0.0368732528109-0.0811422654332-0.202278680959-0.06802240059220.0178502453886-0.146462269199-1.2443860695E-50.3486605919470.03622187915010.01933244309430.3891931642760.05255598853530.304360762083-1.7520455926619.1368822139245.950615514
90.0825497332441-0.0791622593743-0.07587755441830.0681142033627-0.0179294483750.1458157605790.0624930302585-0.08665946857450.107969200362-0.0215578879612-0.05681802804080.13095968593-0.226496116604-0.576833108825-6.0920552715E-50.4216746132710.1027387293230.002100536354140.437537975816-0.00868530398560.362306932264-3.7449504621440.4350921935246.152855629
100.3268743862310.05656232682670.3823601266220.446320587235-0.319323215630.4752183191580.208839599632-0.0556177412640.150741443184-0.0988943301958-0.0994542017238-0.168856425882-0.3686973326310.123651134454-1.45114997459E-50.416059335945-0.007027153837130.01317704361530.2169046544410.00779067457510.42997287870523.22438079542.1976135182229.029616932
110.10194941773-0.04747965361460.00520321081650.0890601406899-0.05279964900490.0627834647821-0.06220265801030.0285030633223-0.08151115944670.112132708105-0.004647553327060.02882933032690.04590591578910.0374265325395-2.20712464138E-60.4154450824010.0118282355690.03761315851070.2201738457370.01407198800360.42039312785820.523382048438.5973458472225.380931085
120.4542033239330.3299308770180.3189505834210.689636232047-0.06231683363090.273168137769-0.01451266028870.0797140378277-0.0496916380891-0.03898590341630.0318689681518-0.152647976210.0721448230270.04434012277157.8828036812E-70.3909126842140.01091537258760.0574181146130.227845980350.006542210508780.41171482488721.667112977137.5444596931222.345166599
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180.3356982889470.000625642549986-0.1355442492990.514509061659-0.1553542697490.0774937298369-0.107891399942-0.1333069668420.139774683683-0.0939012631805-0.12799855195-0.0211382631846-0.141676879924-0.119304852618-2.23869650479E-60.4435261725070.09775074813080.009667610363310.596361068843-0.09069281041030.33285582976-14.456404738328.3637307582274.254496655
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230.630962918775-0.627240251844-0.08927080840980.722389527497-0.6401465809670.51881429464-0.0955201211174-0.4054192091090.095589415150.4210036468280.0898296504538-0.0806229702536-0.05743058593690.005450732245765.64334725279E-60.4191156206210.00295003834967-0.0469018870920.4365829234880.003892739685590.39287714315127.140636300533.3008053665249.189458038
240.188051213296-0.0834446508633-0.03622542751710.1635518889920.126461944410.0434535839468-0.170363982383-0.0792923968456-0.0496197151830.05413910223390.0574108146133-0.2577363528980.007602061836770.0550430940431-1.84697290326E-50.3720976966690.0196206377409-0.04064563842650.4289755959850.1010860051450.50460348622834.169955791727.3852311141244.982843266
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270.855323032216-0.457752075024-0.3069445495610.4606586649090.5235257517320.8032031792570.08437954026630.154089805738-0.08344374845150.012191466934-0.0635621674728-0.0426688266759-0.0874553630887-0.116005435804-1.59897372341E-60.3522157184790.03169333482160.01049517831410.231461124342-0.003896746191370.306986481329-2.7764855203520.3349925246221.161421618
281.1884468388-0.148287980415-0.3833370690050.161237154098-0.5044080031.21309652304-0.008249892121030.159493912233-0.00375749777140.2851104260220.185129334216-0.130884993346-0.261276026248-0.1552671403570.1946588507990.4534216371110.0451040710872-0.01317297081850.194438849904-0.1058260606180.396696829813.6217921651628.8807866826226.758588988
290.1648180817430.1195728361060.1874559655890.7286217750650.2224435909160.7712073906850.136080842778-0.1734760950710.03462657029120.0210438665161-0.0640988315694-0.0178890723302-0.0354927472081-0.06797249606281.34287042837E-50.4039206525340.0644072536427-0.02850271797960.391337224361-0.04112197432320.326687076965-14.10619157725.7357277155234.611780251
300.144884561180.0217718808761-0.05201213430470.05867328541270.06445051961830.152106085867-0.09531143635940.008482977789030.472460467297-0.402562673569-0.0545965314517-0.292918719269-0.167709536816-0.511197896933-0.001770422125110.4001943688340.0298660081327-0.04744785635440.5975199942480.1481491377480.81209849879-61.495213907858.7393520656178.265721536
310.0225395253937-0.02506612101880.007018089219750.012275030604-0.0059926182725-0.01127423117-0.1185617253520.1111968756470.05586535237140.0407725043856-0.1492376669770.548094013437-0.0296880728829-0.632173998981-0.07742790416840.397673538568-0.00409503113649-0.1866829779320.9224300856750.1162121197330.92016745167-81.940286568846.8626579329175.71943651
320.0630682455434-0.127099064075-0.1403057917480.2756904130060.2105043788420.578066261327-0.0359051307318-0.0130697196693-0.128033457198-0.1135925465640.1594851774570.0711024511866-0.347549995203-0.6317097833920.4231388831510.2883436003320.0614603324739-0.08560984091370.7603165979970.1379149759430.673163686078-69.359477713252.0072230148181.11441886
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360.02780717240210.00183043302934-0.01684478112160.01225645655940.006160178999860.00959868829913-0.0910048561538-0.198755350706-0.3453365945750.01425795126770.2496619815570.233358468518-0.242305855976-0.1609057608230.0001005662787180.3547449840167.3930418166E-5-0.03797980144950.5043321046890.07876272176570.537087861396-57.847203243449.1082000247187.492337258
370.146380242559-0.14692284235-0.06407784448620.0945574061720.156767826170.0957443127901-0.252643185655-0.06838826084430.219498242676-0.1193501933390.1527143586720.135191210545-0.130690580511-0.2466668609990.00201930760110.2868673397660.0231482860823-0.02563955468920.5844344998580.05742004428350.560238345858-63.610355608451.4382695192183.298667876
380.0940335158431-0.191199511584-0.03903986577470.384893848170.07683627229020.0842806753545-0.06578414738150.01674428399390.168634682649-0.1048939722170.126638546721-0.0840921611483-0.276082473844-0.1002148268340.08810325313250.5202833489550.185369196578-0.2341629563011.226879909090.04280955834531.34756183701-85.620389848257.5837988071179.108070055
390.0182230241324-0.0555436806959-0.07572550100530.05663081804210.09313066122460.4931825335870.146804017239-0.1797645392440.197738243902-0.00240567471684-0.005465927417920.508501599573-0.60743520497-0.7375328910130.08156629834780.4031056919760.146986411227-0.09006873319530.586655655073-0.04323681852441.06069793805-65.861273193464.900587435184.475373873
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精密化 TLSグループ
IDRefine-IDRefine TLS-IDSelection details
1X-RAY DIFFRACTION1chain 'A' and (resid 0 through 83 )
2X-RAY DIFFRACTION2chain 'A' and (resid 84 through 158 )
3X-RAY DIFFRACTION3chain 'A' and (resid 159 through 182 )
4X-RAY DIFFRACTION4chain 'A' and (resid 183 through 270 )
5X-RAY DIFFRACTION5chain 'B' and (resid 1 through 120 )
6X-RAY DIFFRACTION6chain 'B' and (resid 121 through 200 )
7X-RAY DIFFRACTION7chain 'C' and (resid 0 through 84 )
8X-RAY DIFFRACTION8chain 'C' and (resid 85 through 158 )
9X-RAY DIFFRACTION9chain 'C' and (resid 159 through 171 )
10X-RAY DIFFRACTION10chain 'C' and (resid 172 through 195 )
11X-RAY DIFFRACTION11chain 'C' and (resid 196 through 216 )
12X-RAY DIFFRACTION12chain 'C' and (resid 217 through 270 )
13X-RAY DIFFRACTION13chain 'D' and (resid 1 through 102 )
14X-RAY DIFFRACTION14chain 'D' and (resid 103 through 135 )
15X-RAY DIFFRACTION15chain 'D' and (resid 136 through 165 )
16X-RAY DIFFRACTION16chain 'D' and (resid 166 through 198 )
17X-RAY DIFFRACTION17chain 'E' and (resid 3 through 73 )
18X-RAY DIFFRACTION18chain 'E' and (resid 74 through 109 )
19X-RAY DIFFRACTION19chain 'E' and (resid 110 through 124 )
20X-RAY DIFFRACTION20chain 'E' and (resid 125 through 203 )
21X-RAY DIFFRACTION21chain 'E' and (resid 204 through 244 )
22X-RAY DIFFRACTION22chain 'F' and (resid 0 through 30 )
23X-RAY DIFFRACTION23chain 'F' and (resid 31 through 77 )
24X-RAY DIFFRACTION24chain 'F' and (resid 78 through 99 )
25X-RAY DIFFRACTION25chain 'G' and (resid 1 through 109 )
26X-RAY DIFFRACTION26chain 'G' and (resid 110 through 124 )
27X-RAY DIFFRACTION27chain 'G' and (resid 125 through 202 )
28X-RAY DIFFRACTION28chain 'G' and (resid 203 through 215 )
29X-RAY DIFFRACTION29chain 'G' and (resid 216 through 244 )
30X-RAY DIFFRACTION30chain 'H' and (resid 1 through 11 )
31X-RAY DIFFRACTION31chain 'H' and (resid 12 through 19 )
32X-RAY DIFFRACTION32chain 'H' and (resid 20 through 30 )
33X-RAY DIFFRACTION33chain 'H' and (resid 31 through 41 )
34X-RAY DIFFRACTION34chain 'H' and (resid 42 through 46 )
35X-RAY DIFFRACTION35chain 'H' and (resid 47 through 51 )
36X-RAY DIFFRACTION36chain 'H' and (resid 52 through 56 )
37X-RAY DIFFRACTION37chain 'H' and (resid 57 through 71 )
38X-RAY DIFFRACTION38chain 'H' and (resid 72 through 77 )
39X-RAY DIFFRACTION39chain 'H' and (resid 78 through 90 )
40X-RAY DIFFRACTION40chain 'H' and (resid 91 through 97 )

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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