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- PDB-7b28: Complement inhibitor CirpA3 from Rhipicephalus pulchellus -

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基本情報

登録情報
データベース: PDB / ID: 7b28
タイトルComplement inhibitor CirpA3 from Rhipicephalus pulchellus
要素CirpA3
キーワードIMMUNOSUPPRESSANT / Inhibitor / Complement / tick
生物種Rhipicephalus pulchellus (ダニ)
手法X線回折 / シンクロトロン / 分子置換 / 解像度: 2.1 Å
データ登録者Lea, S.M. / Johnson, S. / Braunger, K.
資金援助 英国, 5件
組織認可番号
Wellcome Trust100298 英国
Wellcome Trust209194 英国
Wellcome Trust219477 英国
Medical Research Council (MRC, United Kingdom)S021264 英国
European Molecular Biology Organization (EMBO)ALTF 554-2019 英国
引用ジャーナル: Nat Commun / : 2022
タイトル: Structure and function of a family of tick-derived complement inhibitors targeting properdin.
著者: Braunger, K. / Ahn, J. / Jore, M.M. / Johnson, S. / Tang, T.T.L. / Pedersen, D.V. / Andersen, G.R. / Lea, S.M.
履歴
登録2020年11月26日登録サイト: PDBE / 処理サイト: PDBE
改定 1.02021年12月8日Provider: repository / タイプ: Initial release
改定 1.12022年2月2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 / _citation_author.identifier_ORCID / _citation_author.name
改定 1.22024年5月1日Group: Data collection / Refinement description
カテゴリ: chem_comp_atom / chem_comp_bond / pdbx_initial_refinement_model
改定 1.32024年11月20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
F: CirpA3
A: CirpA3
B: CirpA3
C: CirpA3
D: CirpA3
E: CirpA3
G: CirpA3
H: CirpA3
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)153,0739
ポリマ-152,9778
非ポリマー961
12,809711
1
F: CirpA3


分子量 (理論値)分子数
合計 (水以外)19,1221
ポリマ-19,1221
非ポリマー00
181
タイプ名称対称操作
identity operation1_555x,y,z1
2
A: CirpA3


分子量 (理論値)分子数
合計 (水以外)19,1221
ポリマ-19,1221
非ポリマー00
181
タイプ名称対称操作
identity operation1_555x,y,z1
3
B: CirpA3
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)19,2182
ポリマ-19,1221
非ポリマー961
181
タイプ名称対称操作
identity operation1_555x,y,z1
4
C: CirpA3


分子量 (理論値)分子数
合計 (水以外)19,1221
ポリマ-19,1221
非ポリマー00
181
タイプ名称対称操作
identity operation1_555x,y,z1
5
D: CirpA3


分子量 (理論値)分子数
合計 (水以外)19,1221
ポリマ-19,1221
非ポリマー00
181
タイプ名称対称操作
identity operation1_555x,y,z1
6
E: CirpA3


分子量 (理論値)分子数
合計 (水以外)19,1221
ポリマ-19,1221
非ポリマー00
181
タイプ名称対称操作
identity operation1_555x,y,z1
7
G: CirpA3


分子量 (理論値)分子数
合計 (水以外)19,1221
ポリマ-19,1221
非ポリマー00
181
タイプ名称対称操作
identity operation1_555x,y,z1
8
H: CirpA3


分子量 (理論値)分子数
合計 (水以外)19,1221
ポリマ-19,1221
非ポリマー00
181
タイプ名称対称操作
identity operation1_555x,y,z1
単位格子
Length a, b, c (Å)68.366, 150.298, 68.430
Angle α, β, γ (deg.)90.000, 91.833, 90.000
Int Tables number4
Space group name H-MP1211
Space group name HallP2yb
Symmetry operation#1: x,y,z
#2: -x,y+1/2,-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 49 through 94 or resid 96...
d_2ens_1(chain "B" and (resid 49 through 94 or resid 96...
d_3ens_1(chain "C" and (resid 49 through 94 or resid 96...
d_4ens_1(chain "D" and (resid 49 through 94 or resid 96...
d_5ens_1(chain "E" and (resid 49 through 94 or resid 96...
d_6ens_1(chain "F" and (resid 49 through 94 or resid 96...
d_7ens_1(chain "G" and (resid 49 through 94 or resid 96...
d_8ens_1(chain "H" and (resid 49 through 94 or resid 96...

NCSドメイン領域:
Dom-IDComponent-IDEns-IDBeg label comp-IDEnd label comp-IDLabel asym-IDLabel seq-ID
d_11ens_1SERLYSB2 - 48
d_12ens_1ASNGLYB50 - 51
d_13ens_1ILEGLUB53 - 69
d_14ens_1VALLEUB71 - 89
d_15ens_1TYRALAB91 - 105
d_16ens_1ASNGLYB109 - 118
d_17ens_1PROGLYB120 - 123
d_18ens_1LEUCYSB125 - 129
d_19ens_1GLUALAB132 - 135
d_110ens_1VALGLUB137 - 139
d_111ens_1ASNGLNB141 - 151
d_21ens_1SERLYSC2 - 48
d_22ens_1ASNGLYC50 - 51
d_23ens_1ILEGLUC53 - 69
d_24ens_1VALLEUC71 - 89
d_25ens_1TYRALAC91 - 105
d_26ens_1ASNGLYC109 - 118
d_27ens_1PROGLYC120 - 123
d_28ens_1LEUCYSC125 - 129
d_29ens_1GLUALAC132 - 135
d_210ens_1VALGLUC137 - 139
d_211ens_1ASNGLNC141 - 151
d_31ens_1SERLYSD2 - 48
d_32ens_1ASNGLYD50 - 51
d_33ens_1ILEGLUD53 - 69
d_34ens_1VALLEUD71 - 89
d_35ens_1TYRALAD91 - 105
d_36ens_1ASNGLYD109 - 118
d_37ens_1PROGLYD120 - 123
d_38ens_1LEUCYSD125 - 129
d_39ens_1GLUALAD132 - 135
d_310ens_1VALGLUD137 - 139
d_311ens_1ASNGLND143 - 153
d_41ens_1SERLYSE2 - 48
d_42ens_1ASNGLYE50 - 51
d_43ens_1ILEGLUE53 - 69
d_44ens_1VALLEUE71 - 89
d_45ens_1TYRALAE91 - 105
d_46ens_1ASNGLYE109 - 118
d_47ens_1PROGLYE120 - 123
d_48ens_1LEUCYSE125 - 129
d_49ens_1GLUALAE132 - 135
d_410ens_1VALGLUE137 - 139
d_411ens_1ASNGLNE141 - 151
d_51ens_1SERLYSF2 - 48
d_52ens_1ASNGLYF50 - 51
d_53ens_1ILEGLUF53 - 69
d_54ens_1VALLEUF71 - 89
d_55ens_1TYRALAF91 - 105
d_56ens_1ASNGLYF109 - 118
d_57ens_1PROGLYF120 - 123
d_58ens_1LEUCYSF125 - 129
d_59ens_1GLUALAF132 - 135
d_510ens_1VALGLUF137 - 139
d_511ens_1ASNGLNF141 - 151
d_61ens_1SERLYSA2 - 48
d_62ens_1ASNGLYA50 - 51
d_63ens_1ILEGLUA53 - 69
d_64ens_1VALLEUA71 - 89
d_65ens_1TYRALAA91 - 105
d_66ens_1ASNGLYA109 - 118
d_67ens_1PROGLYA120 - 123
d_68ens_1LEUCYSA125 - 129
d_69ens_1GLUALAA132 - 135
d_610ens_1VALGLUA137 - 139
d_611ens_1ASNGLNA145 - 155
d_71ens_1SERLYSG2 - 48
d_72ens_1ASNGLYG50 - 51
d_73ens_1ILEGLUG53 - 69
d_74ens_1VALLEUG71 - 89
d_75ens_1TYRALAG91 - 105
d_76ens_1ASNGLYG109 - 118
d_77ens_1PROGLYG120 - 123
d_78ens_1LEUCYSG125 - 129
d_79ens_1GLUALAG132 - 135
d_710ens_1VALGLUG137 - 139
d_711ens_1ASNGLNG144 - 154
d_81ens_1SERLYSH2 - 48
d_82ens_1ASNGLYH50 - 51
d_83ens_1ILEGLUH53 - 69
d_84ens_1VALLEUH71 - 89
d_85ens_1TYRALAH91 - 105
d_86ens_1ASNGLYH109 - 118
d_87ens_1PROGLYH120 - 123
d_88ens_1LEUCYSH125 - 129
d_89ens_1GLUALAH132 - 135
d_810ens_1VALGLUH137 - 139
d_811ens_1ASNGLNH141 - 151

NCS oper:
IDCodeMatrixベクター
1given(-0.998782668342, -0.0488332071929, -0.006964143521), (-0.0488270316925, 0.998806692892, -0.00105413947877), (0.00700731017062, -0.000712817785001, -0.99997519444)43.1923728806, 1.24732958191, 31.8833466596
2given(0.110328985629, -0.98487623634, 0.133590097023), (0.989308461301, 0.0959252172104, -0.109850448802), (0.095374437502, 0.144281501919, 0.984929725856)-14.4960222595, -38.1849328979, -13.6770975506
3given(-0.157912892627, 0.978547505722, -0.132318923013), (0.982975102535, 0.143032052526, -0.115333341872), (-0.0939333068689, -0.148278828547, -0.984474439925)59.5440143921, -36.2644185612, 45.8509719637
4given(0.0228387154739, -0.0140930965429, -0.999639823989), (-0.222571932433, 0.974734464619, -0.018827065008), (0.974648720293, 0.222921753343, 0.0191249553685)61.8815204133, -32.2743245543, -6.91557488695
5given(-0.0323065097333, 0.0101104416702, 0.99942686996), (0.14352091018, 0.989632704338, -0.00537204292965), (-0.989119829834, 0.143265102078, -0.0334226383859)-37.3589222613, -40.3736622886, 35.5629158841
6given(0.0839664403234, 0.182356718262, 0.979640579092), (0.994960433325, -0.0694113348167, -0.0723588468409), (0.0548030383883, 0.980779329872, -0.187265942124)-50.2752688528, -82.0884510093, 44.0701463321
7given(-0.0874723482952, -0.174570289708, -0.980751651661), (0.946530098725, 0.29233677287, -0.13645506013), (0.310530772212, -0.940247002218, 0.139664649536)74.8282870617, -67.9509807976, -30.0533951171

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要素

#1: タンパク質
CirpA3


分子量: 19122.100 Da / 分子数: 8 / 由来タイプ: 組換発現 / 由来: (組換発現) Rhipicephalus pulchellus (ダニ) / 発現宿主: Escherichia coli (大腸菌)
#2: 化合物 ChemComp-SO4 / SULFATE ION / 硫酸ジアニオン


分子量: 96.063 Da / 分子数: 1 / 由来タイプ: 合成 / : SO4
#3: 水 ChemComp-HOH / water


分子量: 18.015 Da / 分子数: 711 / 由来タイプ: 天然 / : H2O
研究の焦点であるリガンドがあるかN
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: 2.49 Å3/Da / 溶媒含有率: 50.58 %
結晶化温度: 293 K / 手法: 蒸気拡散法, シッティングドロップ法 / 詳細: 0.2 M ammonium sulphate, 30% (w/v) PEG 4000

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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: Diamond / ビームライン: I04-1 / 波長: 0.9762 Å
検出器タイプ: DECTRIS PILATUS3 6M / 検出器: PIXEL / 日付: 2015年4月15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: 0.9762 Å / 相対比: 1
反射解像度: 2.1→68.33 Å / Num. obs: 78899 / % possible obs: 99 % / 冗長度: 3.4 % / CC1/2: 0.991 / Net I/σ(I): 5.1
反射 シェル解像度: 2.11→2.14 Å / Num. unique obs: 11656 / CC1/2: 0.471

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解析

ソフトウェア
名称バージョン分類
XDSデータ削減
Aimlessデータスケーリング
MOLREP位相決定
Cootモデル構築
PHENIX1.18rc4_3812精密化
精密化構造決定の手法: 分子置換
開始モデル: CirpA1

解像度: 2.1→62.25 Å / 交差検証法: FREE R-VALUE / 位相誤差: 31.4472
立体化学のターゲット値: GeoStd + Monomer Library + CDL v1.2
Rfactor反射数%反射
Rfree0.2504 3223 5.32 %
Rwork0.217 57306 -
obs0.2218 60529 75.38 %
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: 33.86 Å2
精密化ステップサイクル: LAST / 解像度: 2.1→62.25 Å
タンパク質核酸リガンド溶媒全体
原子数9935 0 5 711 10651
拘束条件
Refine-IDタイプDev ideal
X-RAY DIFFRACTIONf_bond_d0.002810148
X-RAY DIFFRACTIONf_angle_d0.531313672
X-RAY DIFFRACTIONf_chiral_restr0.04561407
X-RAY DIFFRACTIONf_plane_restr0.0031818
X-RAY DIFFRACTIONf_dihedral_angle_d15.81653750
Refine LS restraints NCS
Ens-IDDom-IDAuth asym-IDRefine-IDタイプRms dev position (Å)
ens_1d_2BX-RAY DIFFRACTIONTorsion NCS0.551172516361
ens_1d_3BX-RAY DIFFRACTIONTorsion NCS0.679551702071
ens_1d_4BX-RAY DIFFRACTIONTorsion NCS0.770527807564
ens_1d_5BX-RAY DIFFRACTIONTorsion NCS0.553848935171
ens_1d_6BX-RAY DIFFRACTIONTorsion NCS0.430795804876
ens_1d_7BX-RAY DIFFRACTIONTorsion NCS0.681371969605
ens_1d_8BX-RAY DIFFRACTIONTorsion NCS0.723289356428
LS精密化 シェル
解像度 (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
2.1-2.140.386570.28321221X-RAY DIFFRACTION30.14
2.14-2.180.2752470.27671336X-RAY DIFFRACTION33.99
2.18-2.220.3211880.27211576X-RAY DIFFRACTION39.16
2.22-2.260.3303930.26431741X-RAY DIFFRACTION43.57
2.26-2.310.29491000.26191953X-RAY DIFFRACTION48.67
2.31-2.370.28021280.26562214X-RAY DIFFRACTION54.83
2.37-2.420.33571430.26752407X-RAY DIFFRACTION60.17
2.42-2.490.2771420.26992631X-RAY DIFFRACTION66.61
2.49-2.560.2921650.26022853X-RAY DIFFRACTION70.85
2.56-2.650.28021490.25923091X-RAY DIFFRACTION76.53
2.65-2.740.28181660.25653220X-RAY DIFFRACTION80.54
2.74-2.850.29331900.25463435X-RAY DIFFRACTION85.28
2.85-2.980.32222090.24593606X-RAY DIFFRACTION89.9
2.98-3.140.25811940.23313719X-RAY DIFFRACTION93.63
3.14-3.330.29871880.22543747X-RAY DIFFRACTION93.96
3.33-3.590.24262170.21233766X-RAY DIFFRACTION92.55
3.59-3.950.20861990.20043672X-RAY DIFFRACTION91.78
3.95-4.520.22882130.17553686X-RAY DIFFRACTION91.49
4.52-5.70.19322080.1773756X-RAY DIFFRACTION92.63
5.7-62.250.22881830.20343820X-RAY DIFFRACTION93.74
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)
12.35212000149-1.416309971091.800681957221.7311428131-0.1062189081622.13532171420.1270151214840.5793225440850.0118312288493-0.165593718712-0.352441622702-0.06237908621640.01053077482510.1540117407970.2605604751450.1185278322260.01115042913280.04086754924160.3419417145980.06033677799950.2564755976071.94563824096-47.7972453183-9.77681759176
22.250029430721.070313707120.3521139115682.26946857033.30294702097.92504698936-0.03008483363050.182519104437-0.2420812586160.193304746909-0.2368987279350.02543982859920.460264237561-0.2472265586730.2184850560590.1534665178160.04141833831130.02514018089950.1966850629470.04454712025070.190826977627-0.894137980871-53.4584915631-3.50266180816
38.84868546529-0.9136345298453.310426029174.75123597775-0.2098372018897.329924562750.110653087599-0.254696341707-0.6081346574470.5046396912370.0130548599770.06522047610890.138678246712-0.0974554416965-0.1308533307020.1921371867180.03188969399730.02835395826860.217710492843-0.052680823740.184502974079-2.29080575726-58.7418732577-2.17660634049
45.91524234394-1.29809696657-1.108345370729.111521031475.334479676243.123560282770.5440599886780.2048221611810.737346424917-1.00244528888-0.1194485232720.687338843352-1.577279165820.602453281711-0.3547458505440.2980814840840.01700697979380.02399771326570.7372404392230.1451918040290.260233323823-15.5473881467-41.3451569632-12.7167716392
52.473525461130.963467657586-1.633512584721.58101419779-0.1973531141981.53558267189-0.130100498937-0.403985686325-0.041677360083-0.08840949540220.0327437870758-0.06676177335370.0858005988921-0.07404048963350.09755713580270.1117569878560.0510822921124-0.02032292339460.3540639687170.04086525783330.195021407701-0.511631139504-45.7650766918-3.30749515288
63.18105386494-0.844789364939-4.528755675988.04125034679-1.680463485877.8830122087-0.1700712328520.544176450862-0.09849114502870.377566890964-0.30412991578-0.147830551233-0.03514745853550.9421353777390.4151047799350.134508724308-0.0200844461065-0.01711522882710.5316562798270.06986915802550.2610487622276.30912761994-34.5885117938-1.87090497371
76.85252476376-3.91711018067-0.2479395125117.75166030222-0.5590569055135.15035295733-0.652533253281-0.4960567796540.2744710638551.336556442420.6642219235050.298745095146-0.1672952899910.5495138248520.1255571215470.393142104234-0.06548148013570.0249714941430.2167342690070.06336319422790.2518480910897.66536678253-45.04353149365.61380048324
84.47857031426-0.1293925903920.2761973225411.205911585470.4749542072873.025918894850.174348974836-0.3075364112410.2219565594460.00582035653205-0.03897404728180.0001867453717120.1245594205540.344105599062-0.1109296598520.334961284978-0.04883576282850.0704231852470.149141624069-0.05441688121510.15281575128137.3467013972-13.235475305840.9810257165
97.099707363242.34381377038-6.398601283376.96823637198-3.315872696427.73644404615-0.277535086739-0.140910105226-0.910808513407-0.197399261713-0.409121318876-0.7967740610520.4653743269790.4924894921840.7091004527810.2018946709620.005704147041330.0285456478630.277162167581-0.03693697851350.33438939938844.0693257112-22.359792772734.6835166846
104.710639392470.431503793243-2.293993474233.16953698285-0.8455975834177.20605498819-0.603101723351-0.354436169448-0.202593546981-0.2784234080010.4749666706440.4814441130961.237797374420.174999873470.1116792581230.3897726918530.02549123660840.08451242874570.149488624418-0.04991566130790.37061243675733.4959019477-23.288366335436.3273765588
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305.31875016596-0.0946604534722-0.1995364559372.140582302070.03506362859165.056555114020.0754046761755-0.08008965628790.1283450554660.08153801868-0.0520624337960.0429081599984-0.04638786531480.271243989625-0.01440764356530.270502392514-0.04252638107850.05475495786970.178959073899-0.0137058136110.11124952967930.566837354-6.889395187087.56650855738
317.45432941705-3.029811340540.4423709968094.61043278547-5.253684407497.61584634759-1.26669609747-1.20686464931.982985018141.536356867170.445858099345-0.563941311493-2.328563592881.802666989630.7161457121991.12646054795-0.1656020129670.09047353524530.602952575609-0.1842753549580.81609823283541.56657079576.1816813462419.35862702
323.12436445066-1.453576882310.02209452075672.60728250116-0.1659287421314.30162732606-0.09112654046530.1671285264450.0851858227181-0.140300243050.0946488855629-0.108820314728-0.05151098921130.367570519779-0.0105934048230.266591198536-0.07079475886040.02428604630840.24751373971-0.06924748144530.15990465400138.4227345013-6.548516003896.30298678534
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348.21281567811.07318759284-0.888068604734.75721623896-0.2119968388820.7778948573910.2034091251630.677364057089-0.621437457348-0.832861053214-0.00854665861159-0.3401043822650.01369017351591.08535248398-0.1986305895220.3052224448510.02679648585290.1137251202360.5870319405-0.04110289837710.19901532997336.9263589238-14.9776166958-2.36473776199
352.211863799350.466670206594-1.09956962473.93177918775-0.8159801992992.988320094260.0344805295453-0.2895750328510.02854516221370.455056192246-0.006826551135680.0310617697262-0.1118477994360.0643012820163-0.02074506963270.1695441920590.0237322910023-0.03007834058360.193650214740.01449604341290.19601149115821.8055521544-54.322625270927.3267563014
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378.181998848410.5570272188092.364021971764.42586169129-1.309967555534.39578495433-0.171462141620.524938341804-0.871115188961-0.3019545444630.244066154037-0.0227414247634-0.2062322304540.0205641566812-0.08357414329470.261585621865-0.02554688360390.03043311046340.08686946086810.07161068873720.27698275240926.707249367-63.023191669221.2617754805
388.76150193522-3.16537624129-5.395539653244.944945231291.157499049023.452241228210.210780169774-2.116245659481.283411802220.46276988192-0.23362435432-1.08465409447-0.866949946082-0.5542274601660.1266692079260.622966039131-0.0977110469923-0.2044436262350.9694217044710.1192080999830.25401635860339.5463928666-50.556166950837.629758127
395.21373311621-1.032108996740.7889588499152.4526126664-0.1538709290112.30701853780.00567698036417-0.5038540275480.0420283125191-0.0394402602494-0.102034837726-0.20453970448-0.004083675086460.2602106724560.1154813335480.284082153214-0.0582401875551-0.03071139254630.1506115217420.09599388058950.23727466108628.4970522609-52.883995600528.732060974
401.724585678810.524236472451-0.572152038121.24704301635-0.1630135486832.01918489978-0.242154915225-0.4022847586550.372504332292-0.219843245532-0.174129866936-0.0526152618377-0.274016777385-0.1723230018610.3329866883540.3358242642730.0469490368361-0.06340294569980.1523264713160.04697625476110.20641313085926.5660763744-49.201290212723.9826832577
412.59027939253-1.914357447652.301340895181.4084824345-1.709358122681.995322778670.4590405503960.8258025208330.09945106566150.479443649916-0.3940418142390.7277720309840.252926318484-0.564793863147-0.02003817721960.1609684302720.072025868180.06868336702650.530540187153-0.005335182186450.3756992695538.95271901833-52.326520125629.5868439649
429.102005433652.143886026512.383327723424.17024382454-4.677088442128.164870451420.457964369213-1.235016206861.24966784431-0.3336059542210.134446527676-0.630857901579-2.1800469414-1.58447836425-0.1029697131770.8041259385790.1501696633920.1742007612120.24429233296-0.3117102743540.7168921006818.2722573813-40.370619133529.7664517256
433.49589323544-2.70419654326-1.772627682642.080601486071.005348650387.326673362270.405199528762-0.259515255709-0.1875530021740.000720005973616-0.249911477324-0.370800361089-0.03273114796810.96912523379-0.08868074742160.4312671842060.162724536898-0.08946944631230.3768914338160.1194481172180.27656664671714.6240455925-51.080188173419.3919059034
443.177332407360.08538934357560.1335052963033.30858197609-0.450075376143.24742097743-0.177783482206-0.3340650970160.08343822954760.4232369569050.114122663870.24107730827-0.109429698051-0.3026983673620.07941466624890.1610141069880.0511663860670.01913448702240.268511266920.02007774319920.163166589856-14.8947293515-45.144652966722.8470010593
456.275548743781.35370084204-0.5672889062845.29212564322-1.082975217262.3871119851-0.143655357689-0.5600049378120.1313716358080.3087457161860.043528016940.03159949159690.1497477421940.1138459940350.0859186680010.1816909910710.06582812768060.03145918323450.435847393467-0.01203832405860.142741868101-14.671168948-48.227324580529.2646991716
462.85987355676-0.1625367519050.3651959834384.55819266977-0.4995432891275.6353091702-0.103266103055-0.865859732976-0.1812664992480.659022331245-0.0521034609429-0.0978893649930.3087373709640.3699962822880.1339930758890.25468093760.0899126975317-0.005073565521240.4553975563150.07275017498590.292394407086-1.83397094574-52.025764386530.8513602315
473.82870182013-0.259164358117-0.6663150452672.188333972071.215794736323.927235759650.0777779836945-0.263864564661-0.07194175163460.00981200261764-0.0508895580093-0.00485708781955-0.04326458629390.21234492003-0.02552941831850.1091793556920.0247107082086-0.0108121207210.1682285618320.06279755461980.14490135870537.1800925467-43.73094801374.32897580227
482.31196917136-1.198152105542.461472546341.427109304690.1768312129495.133591035070.0009696726485831.143288814782.54206232908-1.062587177490.326530271319-1.01466675695-2.260089330170.947447129992-0.1687651736330.756696507764-0.2622851809390.2271210797650.4887446311020.22459843421.1031741293748.6765133174-29.2765738902-4.31722166965
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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 'F' and (resid 48 through 66 )FA48 - 661 - 20
22chain 'F' and (resid 67 through 85 )FA67 - 8521 - 39
33chain 'F' and (resid 86 through 108 )FA86 - 10840 - 62
44chain 'F' and (resid 109 through 119 )FA109 - 11963 - 73
55chain 'F' and (resid 120 through 176 )FA120 - 17674 - 126
66chain 'F' and (resid 177 through 188 )FA177 - 188127 - 138
77chain 'F' and (resid 189 through 203 )FA189 - 203139 - 155
88chain 'A' and (resid 48 through 75 )AB48 - 751 - 29
99chain 'A' and (resid 76 through 85 )AB76 - 8530 - 39
1010chain 'A' and (resid 86 through 108 )AB86 - 10840 - 62
1111chain 'A' and (resid 109 through 129 )AB109 - 12963 - 83
1212chain 'A' and (resid 130 through 143 )AB130 - 14384 - 97
1313chain 'A' and (resid 144 through 176 )AB144 - 17698 - 126
1414chain 'A' and (resid 177 through 189 )AB177 - 189127 - 139
1515chain 'A' and (resid 190 through 203 )AB190 - 203140 - 151
1616chain 'B' and (resid 48 through 75 )BC48 - 751 - 29
1717chain 'B' and (resid 76 through 85 )BC76 - 8530 - 39
1818chain 'B' and (resid 86 through 108 )BC86 - 10840 - 62
1919chain 'B' and (resid 109 through 119 )BC109 - 11963 - 73
2020chain 'B' and (resid 120 through 129 )BC120 - 12974 - 83
2121chain 'B' and (resid 130 through 143 )BC130 - 14384 - 97
2222chain 'B' and (resid 144 through 176 )BC144 - 17698 - 126
2323chain 'B' and (resid 177 through 188 )BC177 - 188127 - 138
2424chain 'B' and (resid 189 through 203 )BC189 - 203139 - 151
2525chain 'C' and (resid 48 through 108 )CD48 - 1081 - 62
2626chain 'C' and (resid 109 through 119 )CD109 - 11963 - 73
2727chain 'C' and (resid 120 through 176 )CD120 - 17674 - 126
2828chain 'C' and (resid 177 through 188 )CD177 - 188127 - 138
2929chain 'C' and (resid 189 through 203 )CD189 - 203139 - 153
3030chain 'D' and (resid 48 through 108 )DE48 - 1081 - 62
3131chain 'D' and (resid 109 through 119 )DE109 - 11963 - 73
3232chain 'D' and (resid 120 through 176 )DE120 - 17674 - 126
3333chain 'D' and (resid 177 through 188 )DE177 - 188127 - 138
3434chain 'D' and (resid 189 through 203 )DE189 - 203139 - 151
3535chain 'E' and (resid 48 through 75 )EF48 - 751 - 29
3636chain 'E' and (resid 76 through 85 )EF76 - 8530 - 39
3737chain 'E' and (resid 86 through 108 )EF86 - 10840 - 62
3838chain 'E' and (resid 109 through 119 )EF109 - 11963 - 73
3939chain 'E' and (resid 120 through 143 )EF120 - 14374 - 97
4040chain 'E' and (resid 144 through 166 )EF144 - 16698 - 117
4141chain 'E' and (resid 167 through 176 )EF167 - 176118 - 126
4242chain 'E' and (resid 177 through 188 )EF177 - 188127 - 138
4343chain 'E' and (resid 189 through 203 )EF189 - 203139 - 151
4444chain 'G' and (resid 48 through 119 )GG48 - 1191 - 73
4545chain 'G' and (resid 120 through 166 )GG120 - 16674 - 117
4646chain 'G' and (resid 167 through 203 )GG167 - 203118 - 154
4747chain 'H' and (resid 48 through 107 )HH48 - 1071 - 61
4848chain 'H' and (resid 108 through 119 )HH108 - 11962 - 73
4949chain 'H' and (resid 120 through 166 )HH120 - 16674 - 117
5050chain 'H' and (resid 167 through 203 )HH167 - 203118 - 151

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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