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- PDB-8zys: Crystal structure of HSF5 DNA-binding domain in complex with 3-si... -

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基本情報

登録情報
データベース: PDB / ID: 8zys
タイトルCrystal structure of HSF5 DNA-binding domain in complex with 3-site HSE DNA (25 bp)
要素
  • (DNA (25-MER)) x 2
  • Heat shock factor protein 5
キーワードDNA BINDING PROTEIN/DNA / HSF5 / HSE / DNA BINDING PROTEIN-DNA complex
機能・相同性
機能・相同性情報


male meiotic nuclear division / XY body / DNA-binding transcription repressor activity / DNA-binding transcription activator activity / sequence-specific double-stranded DNA binding / spermatogenesis / cell differentiation / RNA polymerase II cis-regulatory region sequence-specific DNA binding / DNA-binding transcription factor activity / regulation of transcription by RNA polymerase II / nucleus
類似検索 - 分子機能
Heat shock factor (HSF)-type, DNA-binding / HSF-type DNA-binding / heat shock factor / Winged helix DNA-binding domain superfamily / Winged helix-like DNA-binding domain superfamily
類似検索 - ドメイン・相同性
DNA / DNA (> 10) / Heat shock factor protein 5
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: 2 Å
データ登録者Shi, X. / Zhang, Q. / Liu, W.
資金援助 中国, 4件
組織認可番号
Other government2021XZL06 中国
Other governmentCSTB2022TIAD-STX0015 中国
Other governmentZXZYTSYS02 中国
Other government23JSZ01 中国
引用ジャーナル: to be published
タイトル: Crystal structure of HSF5 DNA-binding domain in complex with 3-site HSE DNA (25 bp)
著者: Shi, X. / Zhang, Q. / Liu, W.
履歴
登録2024年6月18日登録サイト: PDBJ / 処理サイト: PDBC
改定 1.02025年3月12日Provider: repository / タイプ: Initial release
改定 1.12025年5月7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.journal_volume / _citation.page_first / _citation.page_last / _citation.pdbx_database_id_DOI / _citation.pdbx_database_id_PubMed / _citation.title / _citation.year

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構造の表示

構造ビューア分子:
MolmilJmol/JSmol

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集合体

登録構造単位
A: Heat shock factor protein 5
B: Heat shock factor protein 5
C: Heat shock factor protein 5
D: Heat shock factor protein 5
E: Heat shock factor protein 5
F: Heat shock factor protein 5
G: DNA (25-MER)
H: DNA (25-MER)
I: DNA (25-MER)
J: DNA (25-MER)


分子量 (理論値)分子数
合計 (水以外)116,50310
ポリマ-116,50310
非ポリマー00
6,539363
1
A: Heat shock factor protein 5
B: Heat shock factor protein 5
C: Heat shock factor protein 5
G: DNA (25-MER)
H: DNA (25-MER)


分子量 (理論値)分子数
合計 (水以外)58,2525
ポリマ-58,2525
非ポリマー00
905
タイプ名称対称操作
identity operation1_555x,y,z1
2
D: Heat shock factor protein 5
E: Heat shock factor protein 5
F: Heat shock factor protein 5
I: DNA (25-MER)
J: DNA (25-MER)


分子量 (理論値)分子数
合計 (水以外)58,2525
ポリマ-58,2525
非ポリマー00
905
タイプ名称対称操作
identity operation1_555x,y,z1
単位格子
Length a, b, c (Å)49.960, 50.000, 126.880
Angle α, β, γ (deg.)78.955, 88.541, 73.066
Int Tables number1
Space group name H-MP1
Space group name HallP1
Symmetry operation#1: x,y,z
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 13 through 53 or resid 71 through 92 or resid 108 through 129))
d_2ens_1(chain "B" and (resid 13 through 53 or resid 71 through 92 or resid 108 through 129))
d_3ens_1(chain "C" and (resid 13 through 53 or resid 71 through 92 or resid 108 through 129))
d_4ens_1(chain "D" and (resid 13 through 53 or resid 71 through 92 or resid 108 through 129))
d_5ens_1(chain "E" and (resid 13 through 53 or resid 71 through 92 or resid 108 through 129))
d_6ens_1(chain "F" and (resid 13 through 92 or resid 108 through 129))
d_1ens_2chain "G"
d_2ens_2chain "I"
d_1ens_3chain "H"
d_2ens_3(chain "J" and resid 2 through 25)

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_1ASNASNPROPROAA13 - 5310 - 50
d_12ens_1LEULEUVALVALAA71 - 9268 - 89
d_13ens_1LEULEUARGARGAA108 - 129105 - 126
d_21ens_1ASNASNPROPROBB13 - 5310 - 50
d_22ens_1LEULEUVALVALBB71 - 9268 - 89
d_23ens_1LEULEUARGARGBB108 - 129105 - 126
d_31ens_1ASNASNPROPROCC13 - 5310 - 50
d_32ens_1LEULEUVALVALCC71 - 9268 - 89
d_33ens_1LEULEUARGARGCC108 - 129105 - 126
d_41ens_1ASNASNPROPRODD13 - 5310 - 50
d_42ens_1LEULEUVALVALDD71 - 9268 - 89
d_43ens_1LEULEUARGARGDD108 - 129105 - 126
d_51ens_1ASNASNPROPROEE13 - 5310 - 50
d_52ens_1LEULEUVALVALEE71 - 9268 - 89
d_53ens_1LEULEUARGARGEE108 - 129105 - 126
d_61ens_1ASNASNVALVALFF13 - 9210 - 89
d_62ens_1LEULEUARGARGFF108 - 129105 - 126
d_11ens_2DADADCDCGG1 - 21 - 2
d_21ens_2DADADCDCII1 - 21 - 2
d_11ens_3DGDGDGDGHH22
d_21ens_3DGDGDGDGJJ22

NCSアンサンブル:
ID
ens_1
ens_2
ens_3

NCS oper:
IDCodeMatrixベクター
1given(-0.300767955039, -0.953653802694, -0.00911382630726), (-0.953300443719, 0.300353377955, 0.0317192742169), (-0.0275118379581, 0.0182283559042, -0.999455264538)61.2500708687, 43.6688666924, 78.502833075
2given(0.974728316968, -0.22124325922, -0.0309213251794), (0.221176199862, 0.97521769649, -0.00561543122649), (0.0313973998204, -0.00136554136945, 0.999506047296)18.4227243995, 5.40111220593, -26.25171371
3given(-0.295611203702, -0.955306427704, -0.00190930173233), (-0.955307583389, 0.295612888751, -0.000664171764323), (0.00119890175615, 0.00162763380915, -0.999997956719)62.4755049235, 46.079840613, 120.213522431
4given(0.99979571612, -0.0091516576149, -0.0180214647498), (0.00946297494477, 0.999806150237, 0.0172659796309), (0.0178599589592, -0.017432989139, 0.999688507864)2.28247408753, 0.210749908799, 42.0523981051
5given(-0.483037051798, -0.875587150935, -0.00472733615303), (-0.87497134934, 0.482478725302, 0.0404897204885), (-0.0331714398835, 0.0236943189055, -0.999168771944)52.3225193667, 29.3888199524, 146.563709236
6given(-0.287994618581, -0.957626667544, -0.00320394701049), (-0.95761726044, 0.288007145761, -0.00458982546874), (0.0053180989019, 0.00174630992356, -0.99998433399)62.2261553263, 46.2635837524, 120.148297971
7given(-0.318977794438, -0.94756249013, -0.0194549210716), (-0.947756606099, 0.318838249228, 0.00997929978737), (-0.00325303718293, 0.021621705003, -0.999760931234)64.1933340659, 45.0943291589, 120.164814744

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要素

#1: タンパク質
Heat shock factor protein 5 / HSF 5 / Heat shock transcription factor 5 / HSTF 5


分子量: 14298.238 Da / 分子数: 6 / 由来タイプ: 組換発現 / 由来: (組換発現) Homo sapiens (ヒト) / 遺伝子: HSF5, HSTF5 / 発現宿主: Escherichia coli BL21(DE3) (大腸菌) / 参照: UniProt: Q4G112
#2: DNA鎖 DNA (25-MER)


分子量: 7651.962 Da / 分子数: 2 / 由来タイプ: 合成 / 由来: (合成) Homo sapiens (ヒト)
#3: DNA鎖 DNA (25-MER)


分子量: 7704.969 Da / 分子数: 2 / 由来タイプ: 合成 / 由来: (合成) Homo sapiens (ヒト)
#4: 水 ChemComp-HOH / water


分子量: 18.015 Da / 分子数: 363 / 由来タイプ: 天然 / : H2O
Has protein modificationN

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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: 2.55 Å3/Da / 溶媒含有率: 51.82 %
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: 0.1 M HEPES pH 7.5, 10% v/v glycol, 5% PEG8000

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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: SSRF / ビームライン: BL18U1 / 波長: 0.9791 Å
検出器タイプ: DECTRIS PILATUS3 6M / 検出器: PIXEL / 日付: 2023年1月7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: 0.9791 Å / 相対比: 1
反射解像度: 2→50 Å / Num. obs: 75257 / % possible obs: 96.7 % / 冗長度: 3.52 % / Biso Wilson estimate: 39.03 Å2 / CC1/2: 0.996 / Net I/σ(I): 10.8
反射 シェル解像度: 2→2.05 Å / Num. unique obs: 5547 / CC1/2: 0.893

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解析

ソフトウェア
名称バージョン分類
PHENIX1.19.1_4122精密化
XDSJan 10, 2022データ削減
XDSJan 10, 2022データスケーリング
PHENIX1.19.1_4122位相決定
BUSTER2.10.4精密化
精密化構造決定の手法: 分子置換 / 解像度: 2→41.51 Å / SU ML: 0.25 / 交差検証法: FREE R-VALUE / σ(F): 1.98 / 位相誤差: 29.3332
立体化学のターゲット値: GeoStd + Monomer Library + CDL v1.2
Rfactor反射数%反射
Rfree0.2409 3843 5.11 %
Rwork0.2129 71306 -
obs0.2144 75149 96.6 %
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: 60.93 Å2
精密化ステップサイクル: LAST / 解像度: 2→41.51 Å
タンパク質核酸リガンド溶媒全体
原子数4782 2021 0 363 7166
拘束条件
Refine-IDタイプDev ideal
X-RAY DIFFRACTIONf_bond_d0.00717196
X-RAY DIFFRACTIONf_angle_d1.181410148
X-RAY DIFFRACTIONf_chiral_restr0.06861084
X-RAY DIFFRACTIONf_plane_restr0.0196952
X-RAY DIFFRACTIONf_dihedral_angle_d27.18961593
Refine LS restraints NCS
Ens-IDDom-IDAsym-IDAuth asym-IDRefine-IDタイプRms dev position (Å)
ens_1d_2AAX-RAY DIFFRACTIONTorsion NCS0.907477271798
ens_1d_3AAX-RAY DIFFRACTIONTorsion NCS1.07545516813
ens_1d_4AAX-RAY DIFFRACTIONTorsion NCS0.660703651164
ens_1d_5AAX-RAY DIFFRACTIONTorsion NCS0.907557775724
ens_1d_6AAX-RAY DIFFRACTIONTorsion NCS1.18016328907
ens_2d_2GGX-RAY DIFFRACTIONTorsion NCS0.403117838363
ens_3d_2HHX-RAY DIFFRACTIONTorsion NCS0.657676800035
LS精密化 シェル
解像度 (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
2-2.030.32511310.30412576X-RAY DIFFRACTION97.13
2.03-2.050.29461460.28022676X-RAY DIFFRACTION95.99
2.05-2.080.29361380.27332651X-RAY DIFFRACTION95.55
2.08-2.110.28241250.26822617X-RAY DIFFRACTION96.82
2.11-2.140.22981370.25372616X-RAY DIFFRACTION96.49
2.14-2.170.30211580.2492686X-RAY DIFFRACTION95.31
2.17-2.210.27331260.24582603X-RAY DIFFRACTION97.64
2.21-2.250.3421520.29622591X-RAY DIFFRACTION95.88
2.25-2.290.31691580.28242618X-RAY DIFFRACTION95.4
2.29-2.330.29621370.24752663X-RAY DIFFRACTION97.59
2.33-2.380.27781470.23452681X-RAY DIFFRACTION94.96
2.38-2.430.29361260.24162595X-RAY DIFFRACTION98.16
2.43-2.490.26351430.2372699X-RAY DIFFRACTION96.08
2.49-2.550.27851460.22852593X-RAY DIFFRACTION97.58
2.55-2.620.26221370.22452678X-RAY DIFFRACTION96.01
2.62-2.70.26321280.22672674X-RAY DIFFRACTION97.39
2.7-2.780.28071310.23282654X-RAY DIFFRACTION96.1
2.78-2.880.26461480.23752659X-RAY DIFFRACTION98.28
2.88-30.25621450.24342636X-RAY DIFFRACTION96.43
3-3.140.25781580.25482671X-RAY DIFFRACTION96.68
3.14-3.30.24441390.21022628X-RAY DIFFRACTION96.44
3.3-3.510.21571490.19932627X-RAY DIFFRACTION96.69
3.51-3.780.24191420.20532644X-RAY DIFFRACTION96.84
3.78-4.160.23711380.17912680X-RAY DIFFRACTION96.97
4.16-4.760.16731500.16312617X-RAY DIFFRACTION97.16
4.76-5.990.2151620.18372652X-RAY DIFFRACTION97.13
6-41.510.22671460.20272621X-RAY DIFFRACTION95.84
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)
14.313656740056.152792554210.01153552252619.512064396991.583030836145.94770566723-0.06607119025570.5910106016070.113745922025-1.372737103950.05365409606280.502930572014-0.08066156367660.0053365351274-0.08200012724190.4781785429090.07060572888670.00266404370990.3378782343840.03576399783880.56819118045332.9963449803-7.1477362594730.06817509
24.96975467819-3.236015612781.650996102093.57384852941-3.188826812053.57723827267-0.4555297216930.184547167759-0.733865384071-0.881010270021-0.341002142705-1.03880184658-0.55863285804-0.3844482996380.225149002150.5599542568350.03264224027510.05570311700520.226256118861-0.07997208216470.60683095972337.1139039682-19.194732672533.3435460964
36.82618065717-0.9191326719895.945679515456.169262129010.5252916997177.391017675610.340125656409-0.379085515908-0.701218641491-0.3506928485330.02857701891790.1549411107470.429540653286-0.4226524736-0.3625979642750.395092960143-0.0307630470961-0.03179935008480.2896476600860.03110494757240.60721584238731.5889689674-16.039804408739.5663440341
42.342174433232.9189473697-0.06820626735138.772828097063.327383823432.55459387541-0.3550683542861.27904000221-0.0779036695943-1.396356123380.69624865324-2.15930473531-0.3124595486931.71240966721-0.6822607826120.682020306164-0.002765906592970.131732265470.872117408738-0.0132213360771.1351674388244.1959198787-8.7137849609537.6944146967
55.91678932274-0.2637062347130.8206886595366.196960219791.777519672723.996190831320.126299280165-0.352383463586-0.2596250341840.4979502731590.06485215062590.06059730047220.236154585152-0.253942342311-0.1293165086190.2372439879710.00317549604405-0.001390238478390.2436394058470.03347674831050.3823837793529.7248085337-6.4926710702143.6815193175
65.24396015854-1.919290256630.7739144220389.39916444505-5.056977834966.95821768470.3197980642450.0384084212434-0.641871117585-0.9385695008310.2532535071731.052911501810.755619174263-1.05540807471-0.4115607564490.3589022291980.0212880439998-0.05792857859450.3824840210030.03198561119550.63113167361622.5963522815-8.2275873959333.1309565377
72.056171202041.223852002991.807019801711.486367002642.295644527463.528764489330.048359073256-0.6086491670612.46104375116-0.108235976491-0.4768221471920.554335466336-1.49943865234-0.3513179999860.7589395832280.563005626683-0.03387802575160.03799095724420.335553280058-0.03977886886170.92984897522727.88992981695.2372253695234.9424550327
85.282069954-6.37850906101-2.355494452958.312377036214.337528330347.79803591767-0.224375551905-0.974910540428-1.144346752120.4221367533660.103885211819-0.009144937431020.3061944928080.5928836938970.1537341630720.2624488199510.0379802016147-0.01114277262590.3038550439040.07468708045940.51827772182561.76847256567.8181862249446.1625310802
95.246546435630.6575767093052.198916019573.932731206315.498590318278.3061324302-0.1373963788740.136390177714-0.152886938882-0.1127628603820.416412812167-0.6314513561380.05264956775380.400680641401-0.2431460644760.1695715478060.0214071767304-0.00527647796110.2758647772280.0420865568340.41200623598166.750799347810.056650049737.8917866137
103.68393183078-2.39404393198-1.460387701866.181761568772.200693853398.13679432919-0.332107167602-1.19887843805-1.956372729740.571602829426-0.2121443596310.1911910921461.760995274790.9627384630180.2976916077740.5537914634480.07568464605940.005663328867450.5260550315920.1768754444661.0879595808956.0295588093-0.8511621351339.4179755068
112.54031372523-0.09328686595941.061606266618.235035003481.709708501624.33181110965-0.00903782883430.4580435688830.092812998562-0.2945721947470.144238577888-0.090408931951-0.1283455403570.0354839805226-0.1335250713060.2159912459910.0141314797453-0.01363561427390.1812305305920.01804027702260.27269313249558.691993878815.121305517234.0550710654
122.08174468489-1.69878174961-3.301209882275.533343135381.743091921649.0899506089-0.0770167429968-0.6509599657720.6486562104310.3951403719870.32644270513-0.0446167453015-0.2323421286280.304820334499-0.1464655297080.3804696741890.03788643711960.007553633804380.363148459427-0.01772322031650.54442740475257.853804936921.258079229946.4763984054
135.57481615839-3.281598619233.596896231878.002451163024.191496135888.85503352087-0.445984005581.80235131834-0.522234502244-0.911909180755-0.1443257512750.2101217794411.02044908503-0.8695774920310.5090142527271.40605191721-0.3044569126830.1756279621911.4912696946-0.2755133720890.5749397006351.66772452943.848589128845.35569471096
147.06128690497-0.137244998765-0.5694694834394.275379692335.421334623716.972348523460.9596587403470.1954804065120.204161046075-0.729084807643-0.651784822157-1.39475511285-0.78283981848-0.544650931829-0.1173341815891.79950745769-0.1543300327720.3449912909310.861017191628-0.1725405891171.0895616474658.038588242-5.51557605438.36768492711
156.642841911790.801497469297-1.695618728421.13229591828-1.727056790722.6592984805-0.06365566182460.853750003477-1.93677293336-1.56861006156-0.1649535652130.147470671912-0.294908332865-1.607419442580.3394980812011.72453145469-0.200409887023-0.1223978705131.08487286272-0.4191795627281.1160430649444.4915045786-6.1754450859610.7195279554
165.357281185912.843612499924.937350204449.33099297326-3.156429657178.81844506176-0.06447884053111.15156301876-1.2430811343-0.450104798769-0.489430376973-1.038427427782.515349020480.3456133087260.2630093926531.136386395250.08928452616150.1321081293830.735196529644-0.403919294790.92333295361456.3044938622-1.88500826416.6862316155
170.345655061118-0.798086447048-0.182192560013.220710050063.004005130814.76725629346-0.4627025138170.81812653435-0.959036020742-0.751127620573-0.208792464667-1.245778126990.9949961376231.77468865394-0.1452284753761.112235422340.009853532353570.445791338521.5169946175-0.3048765244220.75902345449562.92683509545.5450194261611.4934048594
187.886789710112.05981204826-1.133665296982.873994696843.166050090085.48577087992-0.6328969920981.22609271969-0.935990823741-0.4599796733350.588823919802-0.09521830728770.758006405246-0.1619551278510.07672469556920.730589647099-0.162421690221-0.02480012872510.632075462539-0.09314373182930.44170140726349.15866315055.3379494989918.2178908989
195.010163046073.04121407457-2.908416573374.990900179210.2040657199172.927237546950.1159878398430.64647807396-1.76740035572-0.3129972559881.217671596240.2156473340181.63258064287-1.92243500073-1.531040489120.92306002886-0.3641234066120.07541330077910.741826787775-0.1634032245360.92001521921245.6561000488-0.89898256200518.4946062691
201.664157323070.9208714806770.3120620112683.646716699922.362707964291.57319762641-0.124985900330.884430023713-0.620740897483-1.532063608860.7176254959791.428828741471.15116545466-1.07271629698-0.2895769276461.51231366141-0.621822690564-0.337948770021.55269516327-0.1277980410161.1641038058339.97467262090.7859794193715.99541435972
216.81635637476.687231289813.806037185088.254326373654.572952907632.55737823027-0.333369612721-0.6116553488940.781850441321-1.88826538558-0.5937023827471.47416735514-0.702570599419-0.3202980202740.950265599671.15050118634-0.434476562615-0.35473395711.624911990130.0835814086120.65964575880741.69732159699.516064517874.03563567695
228.70351077524-0.120893106925-1.180436515556.624608640130.3761917077616.30290813156-0.131103366024-0.7356085885590.1663847676430.5179823054220.144452040165-0.626028814646-0.2257397680550.03955016147770.03362256496190.4296300975840.0829499866077-0.06148839909350.388447243464-0.03994490448290.52730610459564.501385708312.489956582487.9604715044
232.331731345160.1582128629630.8430672748499.823602428344.023512188754.06868981104-0.0634930106541-0.200387511635-0.6433458111460.2019417741930.4242588824610.03423023418460.1863691965390.712965733095-0.31464359490.3255029559570.0159127379417-0.01849648086250.4634502731910.003834444119120.64305177216866.36809045766.5333710100278.3806875628
244.65114551751.875141206544.549576732986.044629742632.261480293524.521471967260.61473652839-1.1054717657-1.636294122441.981492890840.268459646261.262172862281.54525427485-1.37184910981-0.8564655528831.01772487837-0.03528446231070.1115744915740.7771252206290.1184159498111.1250339164657.91719383960.6554558999683.1647058393
258.121343007270.8502938351040.735470552248.513744389970.6597573342373.955405374450.09571194071730.290503595946-0.20892124782-0.4437010265040.0923920192742-0.118180017868-0.082238572772-0.0298905580861-0.1116937869110.3233430457040.05422583316050.006104387026130.2653464875360.01267548619550.33908978057558.837386747515.407251515776.9724432641
267.17132226111-3.13657408305-2.99803408545.02784032809-2.082285164616.76748570909-0.0789181563888-0.7366027985291.265639835970.02499180042960.583547392628-1.88914213917-1.074998040810.855493122599-0.3260375109390.405977165050.04236578555980.01552668393150.414506057186-0.09472469716410.76395085857665.281449712721.38443555184.3806896085
278.485103981214.135183593471.290915594849.16650356073.758904083659.539894915160.26233834108-0.4286101455850.1374936937230.8242443711980.2690407404191.027703000620.364004199713-0.733645799795-0.3676656949580.4487882310790.08848469846910.01937670884250.3415594390440.03874958715750.53273322032354.749071076322.279837657889.6120593848
286.16678579462-1.084933974241.224402658262.8603197425-1.730614973088.61955143625-0.08187904689760.483012926072-0.46254323957-0.5444006936730.122157064154-0.8028250368670.3720893920220.4299830698480.03584537891090.2850391892810.06041113729730.002854665918730.25261989859-0.03153375864980.39983446175936.4504410948-11.082937767874.1658541342
293.43474441275-0.4782674173655.330233877975.702453823410.718378155928.955507404430.304702509922-0.181770570067-0.497015683374-0.0597552413563-0.1068890610180.1618983325340.310571995665-0.344087574425-0.1602401843960.317453628523-0.0126521389555-0.007151984862930.176986943589-0.01542191633310.35478217102133.2067496266-14.879253767582.3450816977
306.075100563161.374287434131.819903621182.47959395331-2.207815019853.676113743260.04988145455461.2914244083-0.283698801812-1.112245126520.398725094323-1.430210108481.030029736761.12899726106-0.4107938838750.7294644119210.1368640140790.101316949620.701263295572-0.1252584926771.0644575696246.9464022968-8.4108011951479.6274819339
316.47374672599-1.73972886310.675617207325.840351215860.4019262579846.57623107399-0.0473466601908-0.0134794490498-0.2309735179870.3004371693890.0421541260854-0.01580621413310.0558113002667-0.0827180965128-9.70990456761E-50.2435814888890.01688341417060.006572400624560.15679009241-0.03091713345930.29832825278831.2707466108-4.2604807677585.8910828124
322.91769206203-1.535313874330.4614715385933.79081140315-4.816766092477.140110986580.4113449760660.182075657962-0.530650550165-0.6393216173580.3733879178190.9123440085560.599939349833-1.0492008214-0.6377828300840.4199123036-0.00364834422028-0.03798148619910.3247792846450.02358291954480.54882946176224.3715254426-7.1327773101575.7093420092
333.62751462587-2.6483049846-5.56366024194.957977349152.056102369699.914500458740.474502783475-0.4475191176493.0958761843-0.1873211241470.479711325749-0.240596978954-2.109847290240.351290566531-0.4235507777460.4734433338590.009692552587620.03524466477890.418693259968-0.06972010450421.0724636623429.84158944037.0212825905678.8124107075
344.261405384270.7218834165133.687008126796.503151966931.581300525547.519360625850.208893252024-1.250897664930.07265251656551.17447773063-0.1680789709590.6483497369740.650501712329-0.366497151976-0.1687870525240.914581442281-0.277557084765-0.1627388203790.9073793954210.1755908223360.28725828762643.5650794191-2.53834854049114.925027104
357.28209164109-1.011921222321.915801935174.963606565732.923534923357.892794755510.15964306285-0.129462733277-0.4861579387370.510428814257-0.489650143447-1.185274571360.1928239143711.316506278060.1102643323280.64142376839-0.130850510007-0.09258199769261.344807466880.1784515411110.39984316647153.3020020285-3.95390265767110.302413637
369.26441313850.667757939284-3.930163482817.865726805020.2714872980948.872960253240.276300844281-0.662658225629-1.624483033670.117963555464-0.646550284145-0.1944241583740.6576986064011.246368533010.336365037720.631105181110.136329451896-0.133068383570.8426958169570.1096062582770.72227778690748.0218636111-8.47521930763103.131670818
377.890798239221.69762980869-2.607137672364.18031836234-3.869969984527.0619420070.433335948679-0.990391492092-1.021285093651.00359886077-0.735092756877-0.4052842467261.06853332638-0.349653005440.142315477490.600641492863-0.188321724844-0.03595178268540.534898566660.08898062605950.33976735432938.1534517187-5.56318083948103.82443051
383.47029494418-1.496432561182.656055694214.04342435751.199215571656.694659780860.586771426549-0.2761984740160.3505078732740.53751477752-0.794110070095-0.762108200129-1.15580351021.483534233460.1177648635770.864844208071-0.3517807972610.01607584900360.9934577745210.03934663758470.4044485763448.81933562355.10363420074106.533205518
391.836396909810.37767654210.9209904000020.355275164460.3391111559840.5948951238230.0787251254021-0.5676839097950.2372629430080.268033355997-0.2507549699410.36653220075-0.488953957112-0.20456084463-0.04007139271861.30522491628-0.335617453003-0.1604093069040.877836869627-0.293394992345-0.73609682101840.67017866838.58173373153115.441676507
406.322624562122.16566439359-5.349287965741.98221069685-1.576751628814.290720372310.0100980866841-0.5162674503110.5066038225320.2602271825870.08847370375470.0385898536202-0.01943145219510.43731254202-0.1250152126660.2577452797340.0688916536928-0.03095057618390.233915657314-0.005022893308610.34320936676236.9849619273.7519096152345.0048054205
410.4821568540411.28400933894-0.3425669157813.35965133145-1.156529246520.4141553034160.2539886182260.626506716180.47138553838-1.034865579680.1962030041920.556232837210.02635618158011.11280191833-0.3671269727030.575122350292-0.07069096532640.006102203766190.9797351812980.1480809326670.36093742736354.992059282522.533776460513.3797419179
420.281981753242-0.4250952426080.06326366857252.19949163427-2.033032155492.4068234222-0.2199312517021.089210691660.230735675611-1.114401177270.5728890059590.0107834608071-0.828441951471-0.245088697484-0.1061929527630.926956156742-0.1970215124880.02110143414010.8769198747690.163930247680.34471974878655.189090048722.334759950412.7723024187
434.371208039122.13725265331-2.385799231822.78130765826-1.73663583963.143414487120.12068081265-0.3184836450560.5601141791050.1534613655490.09715043412390.385866698034-0.119784401785-0.178385816474-0.2586822588930.2222192861090.0554561359928-0.01607261866440.295794785409-0.02345459569990.52375982280936.98047318386.7016545189644.3540108494
445.81143427534-1.83220606284-5.223834552786.00739633255.499014267747.572724892270.2369221663340.4705222934720.359927668843-0.7650205315530.355725239348-0.8349954273212.463684335771.29434970589-0.2672275112860.8093073842670.1809188722820.05207288032770.4368260159670.1098402994040.43807707288259.023553767716.570446497763.8317214031
452.116976354212.66601690047-2.80689085933.47951592211-3.686326704273.84778508723-0.0724751498681-0.1049299369671.10728720021-0.3208681178420.3955978963051.793968814890.0661116758503-0.341094376948-0.4460463665720.3831137314410.0517232634035-0.01009800700510.4174561961930.1314969424640.73921777428643.03816959714.530353887473.3468369294
465.051085816741.66856614811-2.343681588091.79944565943-0.5416778290786.163088150410.251454972904-0.3104933772940.3283942787110.233970856908-0.001452253925330.308565014704-0.160817633182-0.180028393148-0.3642638652660.3507831125440.000489276303470.02737360621420.2774975545270.009740385754230.44149045570434.19401270234.5327071609493.9999331872
470.277962993818-1.123794362341.20935709798.72884262001-3.108386197316.024052464750.0299518222014-1.810946509750.04159459823081.843292609211.149272492371.174545597512.23592344998-0.595609194774-0.4803799993181.38804164125-0.2918454433260.1682254686772.022589428620.02834987499470.64820916760122.8407815532-4.87955938028114.944971853
480.278138119289-0.9651954574290.2115975381524.45940413545-1.010558298780.2087816603170.765583478718-1.395575944510.2812111566671.47574970567-0.33607228211.30480877994-0.907291942478-2.50138463747-0.08706938904920.917269910749-0.2669245625740.4079138004631.57300534418-0.08656766409650.52261117904224.0881895782-0.0909229918036110.343731004
494.935792970653.55080454467-3.66217717884.15775802687-2.609194391984.136835226910.1363196610920.2302011009340.731604759705-0.1714848005640.3019716551460.320230703059-0.191391322043-0.0256061289945-0.511042031340.332629113520.0507209199046-0.02823680559350.2860747604370.01913166149160.48581055394244.006487352511.824058384476.9347402296
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 'A' and (resid 11 through 23 )AA11 - 231 - 13
22chain 'A' and (resid 24 through 29 )AA24 - 2914 - 19
33chain 'A' and (resid 30 through 50 )AA30 - 5020 - 40
44chain 'A' and (resid 51 through 76 )AA51 - 7641 - 51
55chain 'A' and (resid 77 through 108 )AA77 - 10852 - 72
66chain 'A' and (resid 109 through 126 )AA109 - 12673 - 90
77chain 'A' and (resid 127 through 131 )AA127 - 13191 - 95
88chain 'B' and (resid 11 through 29 )BB11 - 291 - 19
99chain 'B' and (resid 30 through 50 )BB30 - 5020 - 40
1010chain 'B' and (resid 51 through 76 )BB51 - 7641 - 52
1111chain 'B' and (resid 77 through 112 )BB77 - 11253 - 76
1212chain 'B' and (resid 113 through 131 )BB113 - 13177 - 95
1313chain 'C' and (resid 13 through 23 )CC13 - 231 - 11
1414chain 'C' and (resid 24 through 29 )CC24 - 2912 - 17
1515chain 'C' and (resid 30 through 37 )CC30 - 3718 - 25
1616chain 'C' and (resid 38 through 50 )CC38 - 5026 - 38
1717chain 'C' and (resid 51 through 76 )CC51 - 7639 - 51
1818chain 'C' and (resid 77 through 107 )CC77 - 10752 - 72
1919chain 'C' and (resid 108 through 112 )CC108 - 11273 - 77
2020chain 'C' and (resid 113 through 120 )CC113 - 12078 - 85
2121chain 'C' and (resid 121 through 129 )CC121 - 12986 - 94
2222chain 'D' and (resid 10 through 37 )DD10 - 371 - 28
2323chain 'D' and (resid 38 through 50 )DD38 - 5029 - 41
2424chain 'D' and (resid 51 through 76 )DD51 - 7642 - 53
2525chain 'D' and (resid 77 through 108 )DD77 - 10854 - 72
2626chain 'D' and (resid 109 through 120 )DD109 - 12073 - 84
2727chain 'D' and (resid 121 through 131 )DD121 - 13185 - 95
2828chain 'E' and (resid 12 through 29 )EE12 - 291 - 18
2929chain 'E' and (resid 30 through 50 )EE30 - 5019 - 39
3030chain 'E' and (resid 51 through 76 )EE51 - 7640 - 52
3131chain 'E' and (resid 77 through 108 )EE77 - 10853 - 71
3232chain 'E' and (resid 109 through 126 )EE109 - 12672 - 89
3333chain 'E' and (resid 127 through 132 )EE127 - 13290 - 95
3434chain 'F' and (resid 12 through 23 )FF12 - 231 - 12
3535chain 'F' and (resid 24 through 37 )FF24 - 3713 - 26
3636chain 'F' and (resid 38 through 50 )FF38 - 5027 - 39
3737chain 'F' and (resid 51 through 86 )FF51 - 8640 - 58
3838chain 'F' and (resid 87 through 120 )FF87 - 12059 - 80
3939chain 'F' and (resid 121 through 130 )FF121 - 13081 - 90
4040chain 'G' and (resid 1 through 15 )GG1 - 15
4141chain 'G' and (resid 16 through 25 )GG16 - 25
4242chain 'H' and (resid 2 through 11 )HH2 - 11
4343chain 'H' and (resid 12 through 25 )HH12 - 25
4444chain 'I' and (resid 1 through 5 )II1 - 5
4545chain 'I' and (resid 6 through 10 )II6 - 10
4646chain 'I' and (resid 11 through 20 )II11 - 20
4747chain 'I' and (resid 21 through 25 )II21 - 25
4848chain 'J' and (resid 1 through 10 )JJ1 - 10
4949chain 'J' and (resid 11 through 25 )JJ11 - 25

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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

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