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5N2M
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BU of 5n2m by Molmil
Crystal structure of the first bromodomain of human BRD4 in complex with a tetrahydroquinoline analogue
分子名称: 1,2-ETHANEDIOL, Bromodomain-containing protein 4, propan-2-yl ~{N}-[(2~{S},4~{R})-6-(3-acetamidophenyl)-1-ethanoyl-2-methyl-3,4-dihydro-2~{H}-quinolin-4-yl]carbamate
著者Tallant, C, Slavish, P.J, Siejka, P, Bharatham, N, Shadrick, W.R, Chai, S, Young, B.M, Boyd, V.A, Heroven, C, Wiggers, H.J, Picaud, S, Fedorov, O, Krojer, T, Chen, T, Lee, R.E, Guy, R.K, Shelat, A.A, von Delft, F, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Knapp, S, Structural Genomics Consortium (SGC)
登録日2017-02-07
公開日2018-02-28
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.54 Å)
主引用文献Crystal structure of the first bromodomain of human BRD4 in complex with a tetrahydroquinoline analogue
To Be Published
5N2L
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BU of 5n2l by Molmil
Crystal structure of the second bromodomain of human BRD2 in complex with a tetrahydroquinoline analogue
分子名称: 1,2-ETHANEDIOL, Bromodomain-containing protein 2, SULFATE ION, ...
著者Tallant, C, Slavish, P.J, Siejka, P, Bharatham, N, Shadrick, W.R, Chai, S, Young, B.M, Boyd, V.A, Heroven, C, Wiggers, H.J, Picaud, S, Fedorov, O, Krojer, T, Chen, T, Lee, R.E, Guy, R.K, Shelat, A.A, von Delft, F, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Knapp, S, Structural Genomics Consortium (SGC)
登録日2017-02-07
公開日2018-02-28
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.89 Å)
主引用文献Crystal structure of the second bromodomain of human BRD2 in complex with a tetrahydroquinoline analogue
To Be Published
5EK9
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BU of 5ek9 by Molmil
Crystal structure of the second bromodomain of human BRD2 in complex with a tetrahydroquinoline inhibitor
分子名称: Bromodomain-containing protein 2, propan-2-yl ~{N}-[(2~{S},4~{R})-1-ethanoyl-6-(furan-2-yl)-2-methyl-3,4-dihydro-2~{H}-quinolin-4-yl]carbamate
著者Tallant, C, Slavish, P.J, Siejka, P, Bharatham, N, Shadrick, W.R, Chai, S, Young, B.M, Boyd, V.A, Heroven, C, Picaud, S, Fedorov, O, Chen, T, Lee, R.E, Guy, R.K, Shelat, A.A, von Delft, F, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Knapp, S, Structural Genomics Consortium (SGC)
登録日2015-11-03
公開日2016-11-16
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.08 Å)
主引用文献Exploiting a water network to achieve enthalpy-driven, bromodomain-selective BET inhibitors.
Bioorg. Med. Chem., 26, 2018
6DDJ
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BU of 6ddj by Molmil
Crystal Structure of the human BRD2 BD2 bromodimain in complex with a Tetrahydroquinoline analogue
分子名称: 1,2-ETHANEDIOL, 4-{[(2S,4R)-1-acetyl-2-methyl-6-(1H-pyrazol-3-yl)-1,2,3,4-tetrahydroquinolin-4-yl]amino}benzonitrile, Bromodomain-containing protein 2
著者White, S.W, Yun, M.
登録日2018-05-10
公開日2019-11-13
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.05 Å)
主引用文献Bromodomain-Selective BET Inhibitors Are Potent Antitumor Agents against MYC-Driven Pediatric Cancer.
Cancer Res., 80, 2020
6DDI
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BU of 6ddi by Molmil
Crystal Structure of the human BRD2 BD1 bromodomain in complex with a Tetrahydroquinoline analogue
分子名称: 1,2-ETHANEDIOL, 4-{[(2S,4R)-1-acetyl-2-methyl-6-(1H-pyrazol-3-yl)-1,2,3,4-tetrahydroquinolin-4-yl]amino}benzonitrile, Bromodomain-containing protein 2, ...
著者White, S.W, Yun, M.
登録日2018-05-10
公開日2019-11-13
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Bromodomain-Selective BET Inhibitors Are Potent Antitumor Agents against MYC-Driven Pediatric Cancer.
Cancer Res., 80, 2020
7KAX
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BU of 7kax by Molmil
Crystal structure of OhyA(E82A) from Staphylococcus aureus
分子名称: Oleate hydratase
著者Radka, C.D, Rock, C.O.
登録日2020-10-01
公開日2021-01-06
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (3.514 Å)
主引用文献Structure and mechanism of Staphylococcus aureus oleate hydratase (OhyA).
J.Biol.Chem., 296, 2021
7KAV
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BU of 7kav by Molmil
Crystal structure of OhyA-PEG400 complex from Staphylococcus aureus
分子名称: GLYCEROL, HEXAETHYLENE GLYCOL, Oleate hydratase, ...
著者Radka, C.D, Rock, C.O.
登録日2020-10-01
公開日2021-01-06
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.843 Å)
主引用文献Structure and mechanism of Staphylococcus aureus oleate hydratase (OhyA).
J.Biol.Chem., 296, 2021
7KAY
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BU of 7kay by Molmil
Crystal structure of OhyA(E82A)-18:1 complex from Staphylococcus aureus
分子名称: GLYCEROL, OLEIC ACID, Oleate hydratase, ...
著者Radka, C.D, Rock, C.O.
登録日2020-10-01
公開日2021-01-06
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Structure and mechanism of Staphylococcus aureus oleate hydratase (OhyA).
J.Biol.Chem., 296, 2021
7KAZ
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BU of 7kaz by Molmil
Crystal structure of OhyA(E82A)-18:1/h18:0-FAD complex from Staphylococcus aureus
分子名称: (10R)-10-hydroxyoctadecanoic acid, FLAVIN-ADENINE DINUCLEOTIDE, OLEIC ACID, ...
著者Radka, C.D, Rock, C.O.
登録日2020-10-01
公開日2021-01-06
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.854 Å)
主引用文献Structure and mechanism of Staphylococcus aureus oleate hydratase (OhyA).
J.Biol.Chem., 296, 2021
7KAW
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BU of 7kaw by Molmil
Crystal structure of OhyA-PEG400-FAD complex from Staphylococcus aureus
分子名称: FLAVIN-ADENINE DINUCLEOTIDE, GLYCEROL, HEXAETHYLENE GLYCOL, ...
著者Radka, C.D, Rock, C.O.
登録日2020-10-01
公開日2021-01-06
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.105 Å)
主引用文献Structure and mechanism of Staphylococcus aureus oleate hydratase (OhyA).
J.Biol.Chem., 296, 2021

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件を2024-06-12に公開中

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