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PDB: 916 件
5RL7
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BU of 5rl7 by Molmil
PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 helicase in complex with Z364321922
分子名称: 5-(acetylamino)-2-fluorobenzoic acid, Helicase, PHOSPHATE ION, ...
著者Newman, J.A, Yosaatmadja, Y, Douangamath, A, Aimon, A, Powell, A.J, Dias, A, Fearon, D, Dunnett, L, Brandao-Neto, J, Krojer, T, Skyner, R, Gorrie-Stone, T, Thompson, W, von Delft, F, Arrowsmith, C.H, Edwards, A, Bountra, C, Gileadi, O.
登録日2020-09-16
公開日2020-09-30
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.89 Å)
主引用文献Structure, mechanism and crystallographic fragment screening of the SARS-CoV-2 NSP13 helicase.
Nat Commun, 12, 2021
5RLN
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BU of 5rln by Molmil
PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 helicase in complex with Z364328788
分子名称: 3-(acetylamino)-4-fluorobenzoic acid, Helicase, PHOSPHATE ION, ...
著者Newman, J.A, Yosaatmadja, Y, Douangamath, A, Aimon, A, Powell, A.J, Dias, A, Fearon, D, Dunnett, L, Brandao-Neto, J, Krojer, T, Skyner, R, Gorrie-Stone, T, Thompson, W, von Delft, F, Arrowsmith, C.H, Edwards, A, Bountra, C, Gileadi, O.
登録日2020-09-16
公開日2020-09-30
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2.147 Å)
主引用文献Structure, mechanism and crystallographic fragment screening of the SARS-CoV-2 NSP13 helicase.
Nat Commun, 12, 2021
5RM5
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BU of 5rm5 by Molmil
PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 helicase in complex with Z373768900
分子名称: Helicase, N-(1-ethyl-1H-pyrazol-4-yl)cyclobutanecarboxamide, PHOSPHATE ION, ...
著者Newman, J.A, Yosaatmadja, Y, Douangamath, A, Aimon, A, Powell, A.J, Dias, A, Fearon, D, Dunnett, L, Brandao-Neto, J, Krojer, T, Skyner, R, Gorrie-Stone, T, Thompson, W, von Delft, F, Arrowsmith, C.H, Edwards, A, Bountra, C, Gileadi, O.
登録日2020-09-16
公開日2020-09-30
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2.06 Å)
主引用文献Structure, mechanism and crystallographic fragment screening of the SARS-CoV-2 NSP13 helicase.
Nat Commun, 12, 2021
5RMI
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BU of 5rmi by Molmil
PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 helicase in complex with Z53860899
分子名称: Helicase, PHOSPHATE ION, ZINC ION, ...
著者Newman, J.A, Yosaatmadja, Y, Douangamath, A, Aimon, A, Powell, A.J, Dias, A, Fearon, D, Dunnett, L, Brandao-Neto, J, Krojer, T, Skyner, R, Gorrie-Stone, T, Thompson, W, von Delft, F, Arrowsmith, C.H, Edwards, A, Bountra, C, Gileadi, O.
登録日2020-09-16
公開日2020-09-30
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2.116 Å)
主引用文献Structure, mechanism and crystallographic fragment screening of the SARS-CoV-2 NSP13 helicase.
Nat Commun, 12, 2021
5RH6
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BU of 5rh6 by Molmil
PanDDA analysis group deposition SARS-CoV-2 main protease fragment screen -- Crystal Structure of SARS-CoV-2 main protease in complex with Z4439011588 (Mpro-x2703)
分子名称: 3C-like proteinase, DIMETHYL SULFOXIDE, N-[(1R)-2-[(2-ethyl-6-methylphenyl)amino]-2-oxo-1-(pyridin-3-yl)ethyl]-N-[6-(propan-2-yl)pyridin-3-yl]propanamide
著者Fearon, D, Owen, C.D, Douangamath, A, Lukacik, P, Powell, A.J, Strain-Damerell, C.M, Resnick, E, Krojer, T, Gehrtz, P, Wild, C, Aimon, A, Brandao-Neto, J, Carbery, A, Dunnett, L, Skyner, R, Snee, M, London, N, Walsh, M.A, von Delft, F.
登録日2020-05-15
公開日2020-05-27
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献PanDDA analysis group deposition SARS-CoV-2 main protease fragment screen
To Be Published
5RJI
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BU of 5rji by Molmil
PanDDA analysis group deposition of ground-state model of PHIP
分子名称: PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.24 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RJX
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BU of 5rjx by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z285782452
分子名称: N-methyl-2-(methylsulfonyl)aniline, PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.291 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RKD
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BU of 5rkd by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z2168282707
分子名称: (6S)-1-methyl-4,5,6,7-tetrahydro-1H-benzotriazole-6-carboxylic acid, PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.237 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RKU
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BU of 5rku by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z32367954
分子名称: PH-interacting protein, ~{N}-cyclopropyl-1,3-benzodioxole-5-carboxamide
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RJJ
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BU of 5rjj by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with NCL-00023833
分子名称: 4-bromanyl-1,8-naphthyridine, PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
実験手法X-RAY DIFFRACTION (1.151 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RJY
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BU of 5rjy by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z383325512
分子名称: N-[(1H-pyrazol-4-yl)methyl]acetamide, PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.25 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RKE
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BU of 5rke by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z906021418
分子名称: 5-chloro-2-(propan-2-yl)pyrimidine-4-carboxamide, PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.291 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RKS
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BU of 5rks by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z1696844792
分子名称: 1-(diphenylmethyl)azetidin-3-ol, PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.24 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RJK
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BU of 5rjk by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with NCL-00024661
分子名称: 5-bromo-2-hydroxybenzonitrile, PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.21 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RK0
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BU of 5rk0 by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z30932204
分子名称: N-[(4-sulfamoylphenyl)methyl]acetamide, PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.24 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RKG
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BU of 5rkg by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z1124201124
分子名称: PH-interacting protein, ethyl 1~{H}-pyrazole-4-carboxylate
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.282 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RKW
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BU of 5rkw by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z27678561
分子名称: N-(6-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide, PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.242 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RJL
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BU of 5rjl by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with NCL-00024662
分子名称: (4-bromo-2-methoxyphenyl)methanol, PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.31 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RK2
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BU of 5rk2 by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z54633859
分子名称: 2-[methyl(pyridin-2-yl)amino]ethan-1-ol, PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.235 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RKK
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BU of 5rkk by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z275181224
分子名称: N-[(1-ethyl-1H-pyrazol-4-yl)methyl]pyridine-3-carboxamide, PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.43 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RJT
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BU of 5rjt by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z404993336
分子名称: 5-methyl-N-(1-methyl-1H-pyrazol-4-yl)-1,2-oxazole-3-carboxamide, PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.169 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RK8
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BU of 5rk8 by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z53116498
分子名称: 3-(2-methyl-1H-benzimidazol-1-yl)propanamide, PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.272 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RKJ
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BU of 5rkj by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z373768898
分子名称: N-(1-ethyl-1H-pyrazol-4-yl)cyclopentanecarboxamide, PH-interacting protein
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.46 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RJR
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BU of 5rjr by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z45705015
分子名称: PH-interacting protein, ~{N}-[2-(4-fluorophenyl)ethyl]methanesulfonamide
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.27 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published
5RK7
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BU of 5rk7 by Molmil
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z31721097
分子名称: PH-interacting protein, ethyl morpholine-4-carboxylate
著者Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C.
登録日2020-06-02
公開日2020-06-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.304 Å)
主引用文献PanDDA analysis group deposition of ground-state model
To Be Published

222415

件を2024-07-10に公開中

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