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- PDB-8rtf: Crystal structure of Trypanosoma congolense pyruvate kinase in co... -

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基本情報

登録情報
データベース: PDB / ID: 8rtf
タイトルCrystal structure of Trypanosoma congolense pyruvate kinase in complex with a single-domain antibody (TcoPYK-sdAb42)
要素
  • Camelid single-domain antibody 42 (sdAb42)
  • Pyruvate kinase
キーワードTRANSFERASE / pyruvate kinase / single-domain antibody
機能・相同性
機能・相同性情報


pyruvate kinase / pyruvate kinase activity / potassium ion binding / kinase activity / magnesium ion binding / ATP binding
類似検索 - 分子機能
Pyruvate kinase / Pyruvate kinase, barrel / Pyruvate kinase, insert domain superfamily / Pyruvate kinase, barrel domain / Pyruvate kinase, C-terminal / Pyruvate kinase, C-terminal domain superfamily / Pyruvate kinase, alpha/beta domain / Pyruvate kinase-like, insert domain superfamily / Pyruvate kinase-like domain superfamily / Pyruvate/Phosphoenolpyruvate kinase-like domain superfamily
類似検索 - ドメイン・相同性
生物種Trypanosoma congolense (トリパノソーマ)
Vicugna pacos (アルパカ)
手法X線回折 / シンクロトロン / 分子置換 / 解像度: 2.8 Å
データ登録者Sterckx, Y.G.-J.
資金援助 ベルギー, 3件
組織認可番号
Ghent University Special Research Fund (BOF)BOF.STG.2018.0009.01/01N01518 ベルギー
Research Foundation - Flanders (FWO)G013518N ベルギー
Research Foundation - Flanders (FWO)1137622N ベルギー
引用ジャーナル: Elife / : 2025
タイトル: Allosteric inhibition of trypanosomatid pyruvate kinases by a camelid single-domain antibody.
著者: Pinto Torres, J.E. / Claes, M. / Hendrickx, R. / Yuan, M. / Smiejkowska, N. / Van Wielendaele, P. / Hacisuleyman, A. / De Winter, H. / Muyldermans, S. / Michels, P.A.M. / Walkinshaw, M.D. / ...著者: Pinto Torres, J.E. / Claes, M. / Hendrickx, R. / Yuan, M. / Smiejkowska, N. / Van Wielendaele, P. / Hacisuleyman, A. / De Winter, H. / Muyldermans, S. / Michels, P.A.M. / Walkinshaw, M.D. / Versees, W. / Caljon, G. / Magez, S. / Sterckx, Y.G.
履歴
登録2024年1月26日登録サイト: PDBE / 処理サイト: PDBE
改定 1.02025年4月16日Provider: repository / タイプ: Initial release

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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: Pyruvate kinase
B: Pyruvate kinase
C: Pyruvate kinase
D: Pyruvate kinase
E: Pyruvate kinase
F: Pyruvate kinase
G: Camelid single-domain antibody 42 (sdAb42)
H: Camelid single-domain antibody 42 (sdAb42)
I: Camelid single-domain antibody 42 (sdAb42)
J: Camelid single-domain antibody 42 (sdAb42)
K: Camelid single-domain antibody 42 (sdAb42)
L: Camelid single-domain antibody 42 (sdAb42)
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)437,96822
ポリマ-437,04712
非ポリマー92110
1,54986
1
A: Pyruvate kinase
B: Pyruvate kinase
C: Pyruvate kinase
D: Pyruvate kinase
G: Camelid single-domain antibody 42 (sdAb42)
H: Camelid single-domain antibody 42 (sdAb42)
I: Camelid single-domain antibody 42 (sdAb42)
J: Camelid single-domain antibody 42 (sdAb42)
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)292,10116
ポリマ-291,3658
非ポリマー7378
1448
タイプ名称対称操作
identity operation1_555x,y,z1
2
E: Pyruvate kinase
K: Camelid single-domain antibody 42 (sdAb42)
ヘテロ分子

E: Pyruvate kinase
K: Camelid single-domain antibody 42 (sdAb42)
ヘテロ分子

F: Pyruvate kinase
L: Camelid single-domain antibody 42 (sdAb42)
ヘテロ分子

F: Pyruvate kinase
L: Camelid single-domain antibody 42 (sdAb42)
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)291,73312
ポリマ-291,3658
非ポリマー3684
1086
タイプ名称対称操作
identity operation1_555x,y,z1
crystal symmetry operation2_455-x-1,-y,z1
crystal symmetry operation3_445-x-1/2,y-1/2,-z1
crystal symmetry operation4_455x-1/2,-y+1/2,-z1
単位格子
Length a, b, c (Å)167.520, 170.810, 177.620
Angle α, β, γ (deg.)90.00, 90.00, 90.00
Int Tables number18
Space group name H-MP21212

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要素

#1: タンパク質
Pyruvate kinase


分子量: 56424.305 Da / 分子数: 6 / 由来タイプ: 組換発現 / 詳細: GOL is glycerol
由来: (組換発現) Trypanosoma congolense (トリパノソーマ)
遺伝子: TCIL3000_10_12020 / 発現宿主: Escherichia coli (大腸菌) / 参照: UniProt: G0UYF4, pyruvate kinase
#2: 抗体
Camelid single-domain antibody 42 (sdAb42)


分子量: 16416.826 Da / 分子数: 6 / 由来タイプ: 組換発現 / 由来: (組換発現) Vicugna pacos (アルパカ) / 発現宿主: Escherichia coli (大腸菌)
#3: 化合物
ChemComp-GOL / GLYCEROL / GLYCERIN / PROPANE-1,2,3-TRIOL / グリセロ-ル


分子量: 92.094 Da / 分子数: 10 / 由来タイプ: 合成 / : C3H8O3
#4: 水 ChemComp-HOH / water


分子量: 18.015 Da / 分子数: 86 / 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: 2.91 Å3/Da / 溶媒含有率: 57.69 %
結晶化温度: 293 K / 手法: 蒸気拡散法, ハンギングドロップ法 / pH: 6.5 / 詳細: 100 mM MES pH 6.5, 200 mM MgCl2, 10% PEG 4000

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データ収集

回折平均測定温度: 80 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: 0.98 Å
検出器タイプ: DECTRIS PILATUS3 S 6M / 検出器: PIXEL / 日付: 2016年7月4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: 0.98 Å / 相対比: 1
反射解像度: 2.8→48.35 Å / Num. obs: 125473 / % possible obs: 99.8 % / 冗長度: 10.2 % / CC1/2: 0.998 / Rrim(I) all: 0.139 / Net I/σ(I): 12.53
反射 シェル解像度: 2.8→2.97 Å / 冗長度: 10.2 % / Num. unique obs: 19843 / CC1/2: 0.612 / Rrim(I) all: 2.053 / % possible all: 99.1

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解析

ソフトウェア
名称バージョン分類
PHENIX(1.19.2_4158: ???)精密化
XDSデータ削減
XSCALE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 / 解像度: 2.8→48.35 Å / SU ML: 0.48 / 交差検証法: FREE R-VALUE / σ(F): 1.34 / 位相誤差: 31.1 / 立体化学のターゲット値: ML
Rfactor反射数%反射
Rfree0.2719 6268 5 %
Rwork0.2282 --
obs0.2303 125399 99.78 %
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
精密化ステップサイクル: LAST / 解像度: 2.8→48.35 Å
タンパク質核酸リガンド溶媒全体
原子数25737 0 70 86 25893
拘束条件
Refine-IDタイプDev ideal
X-RAY DIFFRACTIONf_bond_d0.01626310
X-RAY DIFFRACTIONf_angle_d1.82335735
X-RAY DIFFRACTIONf_dihedral_angle_d9.3293762
X-RAY DIFFRACTIONf_chiral_restr0.1244148
X-RAY DIFFRACTIONf_plane_restr0.0234685
LS精密化 シェル
解像度 (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
2.8-2.830.47891960.44973730X-RAY DIFFRACTION96
2.83-2.860.43082080.39613945X-RAY DIFFRACTION100
2.86-2.90.44472080.37633939X-RAY DIFFRACTION100
2.9-2.940.3962050.34463913X-RAY DIFFRACTION100
2.94-2.970.34752080.3043950X-RAY DIFFRACTION100
2.97-3.020.3162070.30233942X-RAY DIFFRACTION100
3.02-3.060.32262080.29573948X-RAY DIFFRACTION100
3.06-3.10.32532090.29673968X-RAY DIFFRACTION100
3.1-3.150.36072060.30423899X-RAY DIFFRACTION100
3.15-3.20.34262070.31423936X-RAY DIFFRACTION100
3.2-3.260.38322070.33253944X-RAY DIFFRACTION100
3.26-3.320.36962080.3233947X-RAY DIFFRACTION100
3.32-3.380.33912100.28663982X-RAY DIFFRACTION100
3.38-3.450.32122070.26583925X-RAY DIFFRACTION100
3.45-3.530.30162080.25653952X-RAY DIFFRACTION100
3.53-3.610.32752070.24353946X-RAY DIFFRACTION100
3.61-3.70.32392110.25064002X-RAY DIFFRACTION100
3.7-3.80.31512090.24653966X-RAY DIFFRACTION100
3.8-3.910.29322080.23583950X-RAY DIFFRACTION100
3.91-4.040.27752100.21913992X-RAY DIFFRACTION100
4.04-4.180.25492090.20673964X-RAY DIFFRACTION100
4.18-4.350.24462090.19873978X-RAY DIFFRACTION100
4.35-4.550.23822090.19123975X-RAY DIFFRACTION100
4.55-4.790.22412110.18154024X-RAY DIFFRACTION100
4.79-5.090.23232100.18413992X-RAY DIFFRACTION100
5.09-5.480.23622120.19854011X-RAY DIFFRACTION100
5.48-6.030.27482120.21874039X-RAY DIFFRACTION100
6.03-6.90.27672140.2184054X-RAY DIFFRACTION100
6.9-8.680.21212140.1894083X-RAY DIFFRACTION100
8.68-48.350.20922210.19774235X-RAY DIFFRACTION99
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)
11.14460.6064-0.2731.89570.02080.8698-0.0008-0.214-0.05930.2335-0.00430.08780.1119-0.01780.01880.6956-0.2215-0.01450.69160.02480.6052-53.92432.718-51.542
21.85560.2755-0.17540.9389-0.54841.54370.6627-1.4479-0.07711.1911-0.6528-0.3799-0.43630.7046-0.18481.8701-0.5599-0.22782.13230.1621.563-26.73627.055-32.92
31.25830.21310.22310.436-0.21721.91770.0385-0.0901-0.09280.0982-0.1382-0.13080.09470.17650.07260.6421-0.16750.00230.61270.04620.6783-44.48532.853-61.125
43.1062-0.5824-1.92462.7308-2.95084.69770.06950.1784-0.3358-0.24710.05490.38820.6466-0.5414-0.06130.6489-0.2335-0.07530.6946-0.03130.6206-62.25328.587-74.694
50.27890.20010.6091.15610.24860.5886-0.10.0694-0.0026-0.03980.1234-0.4452-0.29920.40340.03510.7853-0.3158-0.01860.8837-0.01230.8466-25.19854.98-58.299
60.2172-0.16870.35011.64030.49331.0473-0.2402-0.4140.37640.51780.3086-0.0345-0.38950.7951-0.08871.0514-0.4556-0.02131.0687-0.13391.0226-25.16874.582-47.589
71.3004-1.0664-0.01241.4911-0.88831.4843-0.14860.48050.60290.69470.0136-0.2957-0.4475-0.2491-0.08171.1304-0.2921-0.01450.8481-0.14850.9977-35.72879.981-50.915
81.15980.0953-0.73251.3124-0.00451.80580.0668-0.15350.13410.0954-0.1123-0.0281-0.46590.19150.01980.7949-0.2751-0.04480.65660.01760.7807-37.24963.389-61.583
90.75220.3964-0.44541.17231.04051.65080.0053-0.15030.20690.07560.01890.1047-0.25840.2068-0.00390.8826-0.3942-0.00780.82850.01180.8461-23.72568.136-70.864
100.5268-0.0852-0.50692.80620.03730.6385-0.09990.28730.5490.28360.7835-1.501-1.32211.2806-0.45191.3392-0.6149-0.00471.24250.0011.2889-10.38673.947-73.347
114.4111-0.2459-0.0774.42571.57344.2465-0.15880.25061.1234-0.43970.09-1.2232-1.01560.462-0.15281.1366-0.48760.061.1244-0.00430.944-15.90566.272-80.997
122.23381.07890.20651.3876-0.0011.3472-0.00090.6208-0.2819-0.02290.0230.03660.212-0.1762-0.01720.68-0.0290.0140.9278-0.08850.7138-52.33131.209-122.375
131.19521.3914-0.38692.60290.30242.3014-0.44410.68710.6975-1.01140.20220.1052-1.2860.07920.0241.6798-0.231-0.1341.34990.2231.1618-61.10556.056-142.458
142.24410.375-0.96472.5734-1.02412.285-0.07520.46340.9471-0.80290.2396-0.2338-0.5532-0.2774-0.15371.13520.04950.02071.31370.25371.2891-64.56750.684-133.569
151.40930.226-0.07221.1282-0.3942.13350.07750.39870.17090.0442-0.04080.0583-0.2117-0.3109-0.05020.63140.0083-0.00230.76210.00110.6609-53.04143.118-114.3
162.23440.66262.38043.1137-0.6934.65630.3018-0.1473-0.33690.2236-0.0870.23060.5325-0.9949-0.08260.7172-0.12250.01240.8519-0.06450.6709-59.61226.084-101.728
175.33120.8616-4.77913.12880.46655.3991.1875-14.3411-17.749-4.3051-2.34176.530510.0597-4.51891.14351.48780.0794-0.25121.15210.08811.5783-48.4559.504-96.686
180.89690.28990.30222.0183-0.60411.32510.36990.22310.3665-0.2308-0.2112-0.3827-0.83720.4624-0.07890.8924-0.150.05270.94520.15770.7536-22.0660.089-124.538
192.40460.24380.01663.15850.72951.84490.31120.3291-0.3022-0.7296-0.5624-0.23530.01020.2910.16770.93040.16950.20361.19670.10281.0655-12.17534.495-137.084
201.21660.5417-0.03041.32280.26221.50610.13380.0120.1020.1239-0.1732-0.2299-0.46680.60970.03280.6927-0.1740.06060.78270.08650.7263-23.50454.049-112.03
213.16730.2565-0.70413.740.87872.40740.5274-0.12291.53950.43650.2523-0.2696-1.18080.8806-0.82151.496-0.70910.18011.27360.0691.3238-15.23178.416-102.335
223.59220.7891-0.28016.32890.89036.9649-0.0574-0.33880.95560.72170.017-0.6811-0.77231.4563-0.03041.2098-0.25310.13321.08370.02560.9233-22.13571.966-94.46
232.9767-2.4764-0.25283.03931.30712.9713-2.9161-5.5231-0.5092-5.17795.6854-13.25816.74392.659-2.85881.4982-0.071-0.44771.24920.24511.3635-30.57987.289-98.616
241.74210.1522-1.49951.274-0.57182.07190.4572-0.4327-0.44210.6482-0.7484-0.74940.02330.9315-0.02421.3764-0.7521-0.32221.25380.0720.7625-58.11317.489-14.954
252.12850.3306-0.53961.0349-0.94951.91820.7808-0.56840.17921.1272-0.8551-0.3537-0.04-0.2546-0.11291.2345-0.58630.09040.9680.00690.617-60.36533.764-28.478
261.6205-0.936-0.8011.7551-0.63472.44580.206-0.41640.43790.3767-0.18690.1094-0.8043-0.4317-0.00651.2962-0.47180.16291.0918-0.16340.8807-75.42935.496-18.487
270.01360.05040.28411.79751.38111.71190.6744-0.69080.14751.1005-0.7845-0.0590.1266-0.09730.09021.5664-0.8587-0.04161.36770.08280.6507-69.44317.232-13.346
281.70760.7999-1.06734.24980.29481.99050.24660.0283-0.0713-0.2594-0.3896-0.5766-0.12150.46360.12851.1045-0.50760.00510.87790.05980.6946-70.0439.49-31.728
294.01242.3433-0.81222.241.27883.30190.55560.83510.3191-0.254-0.3184-0.1778-0.0516-0.4169-0.07011.2843-0.4708-0.0271.27210.11780.9154-77.8641.083-29.266
300.917-0.20421.20750.91910.70982.1512-0.52260.78320.16890.58870.2293-1.03250.82081.61930.31861.49940.58040.17911.60270.18981.01-4.109109.311-6.228
310.65210.6810.43021.4298-1.4422.5091-0.08770.18220.0221-0.13390.1773-0.01240.8502-0.1386-0.03771.39680.1928-0.01161.69780.06050.9733-31.792104.189-25.213
322.9992-0.2816-1.35621.58220.33213.7540.52820.18380.0265-0.94060.1810.34392.22520.3301-0.81541.65570.5304-0.34551.1946-0.07411.0057-30.54896.629-9.927
330.9937-0.32070.69970.3818-0.80421.58420.61180.5290.1053-0.4551-0.6112-0.21870.94790.7763-0.0591.82740.78440.00061.6773-0.01080.786-15.156101.988-14.367
343.15181.1464-0.16490.9752-0.22720.26860.78031.09641.1734-0.6477-0.80960.60032.06941.9714-0.12072.55941.3610.02492.47760.23040.6389-6.00297.906-32.504
351.59540.216-0.09730.2814-0.39391.10170.16260.13390.45940.0977-0.3960.34740.3253-0.79440.13680.8507-0.17140.0721.0968-0.09541.1175-80.85262.2-45.933
361.65570.6719-1.40022.30220.21742.5802-0.10750.28320.2456-0.01020.24170.4044-0.1244-0.4365-0.22260.65-0.2101-0.01250.74040.01140.8885-71.05662.787-52.459
373.0049-1.8577-0.24455.15750.55681.7011-0.2078-0.63380.28630.95990.48030.95950.1237-0.11120.00680.8426-0.1239-0.00780.7655-0.03790.9728-70.25462.018-43.619
381.7073-0.10610.28450.769-0.18041.53740.231-0.21251.1763-0.1493-0.0684-0.4549-0.3576-0.2031-0.0180.7753-0.1666-0.08160.7950.03781.2005-80.8470.348-49.688
394.7166-1.55452.42250.6713-1.3162.42660.10560.53120.8367-0.93530.1748-0.40760.0726-0.19070.33380.7709-0.1353-0.00930.76640.03610.8958-64.42662.051-58.67
403.06680.93782.58247.8745-2.00843.24580.10320.27550.5188-0.9690.27921.13750.2366-0.6497-0.35780.6997-0.1082-0.0870.8424-0.07030.7768-74.3657.978-58.781
413.1968-0.30290.04763.63440.76773.08280.15830.32241.22280.37310.30630.4207-0.4082-0.1186-0.39520.79170.1539-0.02770.793-0.14081.4926-87.70170.504-46.722
422.57540.8973-0.39332.01230.57341.43860.2777-0.4275-0.863-0.1048-0.2562-0.65680.30910.90640.04650.8393-0.1498-0.08341.6130.10741.3388-0.68435.238-45.901
431.9521-0.64711.63781.9916-0.23881.9133-0.0811-0.3009-0.167-0.22990.1131-0.25490.00160.3708-0.0510.6213-0.16530.01651.21330.14120.9322-10.53436.148-52.419
442.0849-1.1743-0.19453.9688-0.15211.7758-0.1331-1.1531-0.32671.06940.3108-0.57470.24760.5407-0.21160.7524-0.12990.03051.19580.15281.0816-10.9733.476-43.887
453.1083-0.1124-0.18732.13210.46122.9597-0.0210.5039-0.0977-0.52190.0304-0.59610.15411.1951-0.0420.7017-0.1580.07621.2879-0.07030.9813-5.62833.078-53.733
460.2369-0.57991.04931.5412-2.44894.96250.2317-0.64811.18760.3346-0.23211.0487-0.8383-0.6505-0.32611.7472-0.05940.16481.28070.20062.0232-43.45483.199-129.436
471.81380.17520.32771.6657-0.97971.2358-0.5394-0.49130.9868-0.19620.45280.7778-0.7291-0.49610.13091.39120.1856-0.04481.10850.29431.651-53.4678.352-127.626
482.49310.89410.70091.7883-0.22892.5948-0.68080.80011.1841-1.37870.32571.1922-0.8183-0.56790.04351.48860.0821-0.20911.20310.34761.5995-52.12175.882-135.206
490.5837-0.40080.37510.3812-0.23750.5146-0.2224-0.40820.5562-0.53990.72611.3899-0.2884-1.1026-0.32041.75130.3496-0.08681.43510.19162.5516-58.71485.312-128.201
502.9304-0.57660.21822.61651.0481.3735-0.2017-0.39741.08090.42610.12080.1429-0.109-0.4080.28731.41930.0905-0.00150.92420.20521.4638-49.89876.176-119.724
510.34740.4004-0.34921.19220.21571.4602-0.0068-0.0524-0.0130.1878-0.45550.23480.01110.53330.30012.2903-0.1075-0.98791.32270.68723.8678-60.27692.888-133.281
522.5339-1.2655-0.29511.650.97481.28910.1853-0.42110.1113-0.74930.2905-1.07210.0020.1865-0.38731.0145-0.00430.02820.8593-0.04471.3417-24.1186.745-126.922
530.90250.36620.34341.7115-0.30380.72330.165-0.1664-0.9428-0.2761-0.64530.89530.1205-0.54750.31020.62360.0586-0.07260.8904-0.08560.9626-34.10218.911-124.017
543.5093-0.8970.28635.6032-1.95684.69490.1667-0.9521-1.48311.7720.01160.68711.17690.3064-0.53621.07130.0644-0.09761.09550.20861.2777-21.0048.747-115.543
552.3467-0.4323-1.18922.09121.12861.18370.1191-0.4317-0.7735-0.05950.09860.03390.25880.273-0.24190.68990.0865-0.040.83550.08771.0551-19.39215.575-124.291
562.58340.4197-0.05963.793-0.86871.66310.4696-1.3453-0.66691.1-0.15270.30240.6368-0.5567-0.31890.8888-0.0715-0.04440.99640.14930.9959-28.10818.875-115.062
572.9174-2.0221-0.08631.54740.13360.1162-0.15180.0494-0.24960.6304-0.6543-0.6003-0.4877-0.12870.26061.01560.23320.23130.68960.19571.8145-15.240.096-125.102
582.07640.7308-0.55450.50040.11540.5133-0.39040.0422-0.296-0.80750.58530.32770.57190.5864-0.11741.62520.28740.40082.17750.11771.976-35.8557.851-20.276
590.789-0.3222-1.06493.25011.10641.8173-0.6579-0.599-0.21651.3761-1.3126-0.6344-0.0972-0.48170.58031.9397-0.0427-0.26212.670.14431.5149-21.3984.027-12.443
600.4063-0.70541.10142.5342-1.42644.26630.05610.5285-0.4637-0.3274-0.36440.49291.09820.0663-0.08872.0217-0.779-0.53911.80470.62091.3132-48.6113.594-18.427
610.5597-1.2144-0.26533.60170.74290.2083-0.24560.4183-0.31620.53860.0489-0.47031.45830.7157-0.01412.16810.57670.43681.96110.0951.679-36.6620.02-12.302
621.4116-0.35810.82811.02190.50490.73780.0464-0.694-0.47110.1113-0.0279-1.03381.17591.2618-0.04931.83730.4035-0.13221.99110.07121.7063-34.0273.443-8.445
631.2827-1.39550.17933.4456-1.2330.5874-0.1510.7892-0.7579-0.1080.2654-0.0745-2.05950.3917-0.42052.1911-0.1589-0.28361.2971-0.12151.7418-4.004133.912-21.584
641.7838-0.80730.94971.56930.16321.6783-0.5333-0.01920.0507-0.93310.2447-0.5548-1.70681.30260.20431.978-0.2109-0.02061.81140.25991.3922-0.579135.627-11.687
651.57820.3948-0.19482.32820.19942.39670.53080.61570.63960.33070.3084-0.3219-1.0854-0.6668-0.48821.9226-0.2301-0.03521.98930.02961.2523-1.233143.063-8.846
661.32990.1602-0.08440.4190.74141.3932-1.14370.18820.8747-0.81121.0757-0.7377-1.0411.21490.731.5685-0.3216-0.13592.14650.25941.65112.983132.879-13.283
精密化 TLSグループ
IDRefine-IDRefine TLS-IDSelection detailsAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1( CHAIN A AND RESID 2:98 )A2 - 98
2X-RAY DIFFRACTION2( CHAIN A AND RESID 99:183 )A99 - 183
3X-RAY DIFFRACTION3( CHAIN A AND RESID 184:404 )A184 - 404
4X-RAY DIFFRACTION4( CHAIN A AND RESID 405:500 )A405 - 500
5X-RAY DIFFRACTION5( CHAIN B AND RESID 2:44 )B2 - 44
6X-RAY DIFFRACTION6( CHAIN B AND RESID 45:75 )B45 - 75
7X-RAY DIFFRACTION7( CHAIN B AND RESID 76:204 )B76 - 204
8X-RAY DIFFRACTION8( CHAIN B AND RESID 205:392 )B205 - 392
9X-RAY DIFFRACTION9( CHAIN B AND RESID 393:442 )B393 - 442
10X-RAY DIFFRACTION10( CHAIN B AND RESID 443:467 )B443 - 467
11X-RAY DIFFRACTION11( CHAIN B AND RESID 468:501 )B468 - 501
12X-RAY DIFFRACTION12( CHAIN C AND RESID 2:75 )C2 - 75
13X-RAY DIFFRACTION13( CHAIN C AND RESID 76:166 )C76 - 166
14X-RAY DIFFRACTION14( CHAIN C AND RESID 167:204 )C167 - 204
15X-RAY DIFFRACTION15( CHAIN C AND RESID 205:404 )C205 - 404
16X-RAY DIFFRACTION16( CHAIN C AND RESID 405:499 )C405 - 499
17X-RAY DIFFRACTION17( CHAIN C AND RESID 515:515 )C515
18X-RAY DIFFRACTION18( CHAIN D AND RESID 2:99 )D2 - 99
19X-RAY DIFFRACTION19( CHAIN D AND RESID 100:204 )D100 - 204
20X-RAY DIFFRACTION20( CHAIN D AND RESID 205:442 )D205 - 442
21X-RAY DIFFRACTION21( CHAIN D AND RESID 443:468 )D443 - 468
22X-RAY DIFFRACTION22( CHAIN D AND RESID 469:499 )D469 - 499
23X-RAY DIFFRACTION23( CHAIN D AND RESID 515:515 )D515
24X-RAY DIFFRACTION24( CHAIN E AND RESID 2:44 )E2 - 44
25X-RAY DIFFRACTION25( CHAIN E AND RESID 45:75 )E45 - 75
26X-RAY DIFFRACTION26( CHAIN E AND RESID 76:274 )E76 - 274
27X-RAY DIFFRACTION27( CHAIN E AND RESID 275:425 )E275 - 425
28X-RAY DIFFRACTION28( CHAIN E AND RESID 426:480 )E426 - 480
29X-RAY DIFFRACTION29( CHAIN E AND RESID 481:500 )E481 - 500
30X-RAY DIFFRACTION30( CHAIN F AND RESID 2:22 )F2 - 22
31X-RAY DIFFRACTION31( CHAIN F AND RESID 23:248 )F23 - 248
32X-RAY DIFFRACTION32( CHAIN F AND RESID 249:273 )F249 - 273
33X-RAY DIFFRACTION33( CHAIN F AND RESID 274:425 )F274 - 425
34X-RAY DIFFRACTION34( CHAIN F AND RESID 426:499 )F426 - 499
35X-RAY DIFFRACTION35( CHAIN G AND RESID 1:17 )G1 - 17
36X-RAY DIFFRACTION36( CHAIN G AND RESID 18:73 )G18 - 73
37X-RAY DIFFRACTION37( CHAIN G AND RESID 74:89 )G74 - 89
38X-RAY DIFFRACTION38( CHAIN G AND RESID 90:104 )G90 - 104
39X-RAY DIFFRACTION39( CHAIN G AND RESID 105:113 )G105 - 113
40X-RAY DIFFRACTION40( CHAIN G AND RESID 114:123 )G114 - 123
41X-RAY DIFFRACTION41( CHAIN G AND RESID 124:130 )G124 - 130
42X-RAY DIFFRACTION42( CHAIN H AND RESID 1:17 )H1 - 17
43X-RAY DIFFRACTION43( CHAIN H AND RESID 18:70 )H18 - 70
44X-RAY DIFFRACTION44( CHAIN H AND RESID 71:89 )H71 - 89
45X-RAY DIFFRACTION45( CHAIN H AND RESID 90:130 )H90 - 130
46X-RAY DIFFRACTION46( CHAIN I AND RESID 1:9 )I1 - 9
47X-RAY DIFFRACTION47( CHAIN I AND RESID 10:73 )I10 - 73
48X-RAY DIFFRACTION48( CHAIN I AND RESID 74:90 )I74 - 90
49X-RAY DIFFRACTION49( CHAIN I AND RESID 91:105 )I91 - 105
50X-RAY DIFFRACTION50( CHAIN I AND RESID 106:123 )I106 - 123
51X-RAY DIFFRACTION51( CHAIN I AND RESID 124:130 )I124 - 130
52X-RAY DIFFRACTION52( CHAIN J AND RESID 1:17 )J1 - 17
53X-RAY DIFFRACTION53( CHAIN J AND RESID 18:39 )J18 - 39
54X-RAY DIFFRACTION54( CHAIN J AND RESID 40:51 )J40 - 51
55X-RAY DIFFRACTION55( CHAIN J AND RESID 52:104 )J52 - 104
56X-RAY DIFFRACTION56( CHAIN J AND RESID 105:123 )J105 - 123
57X-RAY DIFFRACTION57( CHAIN J AND RESID 124:131 )J124 - 131
58X-RAY DIFFRACTION58( CHAIN K AND RESID 1:9 )K1 - 9
59X-RAY DIFFRACTION59( CHAIN K AND RESID 10:23 )K10 - 23
60X-RAY DIFFRACTION60( CHAIN K AND RESID 24:34 )K24 - 34
61X-RAY DIFFRACTION61( CHAIN K AND RESID 35:51 )K35 - 51
62X-RAY DIFFRACTION62( CHAIN K AND RESID 52:130 )K52 - 130
63X-RAY DIFFRACTION63( CHAIN L AND RESID 1:7 )L1 - 7
64X-RAY DIFFRACTION64( CHAIN L AND RESID 8:70 )L8 - 70
65X-RAY DIFFRACTION65( CHAIN L AND RESID 71:98 )L71 - 98
66X-RAY DIFFRACTION66( CHAIN L AND RESID 99:130 )L99 - 130

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万見について

-
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