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7JS7
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BU of 7js7 by Molmil
Phospholipase D engineered mutant (TNYR) H442 covalent adduct with 1-inositol phosphate
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, D-MYO-INOSITOL-1-PHOSPHATE, GLYCEROL, ...
著者Vrielink, A, Samantha, A.
登録日2020-08-13
公開日2021-04-28
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structures of an engineered phospholipase D with specificity for secondary alcohol transphosphatidylation: insights into plasticity of substrate binding and activation.
Biochem.J., 478, 2021
7JRU
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BU of 7jru by Molmil
Phospholipase D engineered mutant bound to phosphatidic acid (8 hour soak)
分子名称: (2R)-3-(phosphonooxy)propane-1,2-diyl dibutanoate, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, GLYCEROL, ...
著者Vrielink, A, Samantha, A.
登録日2020-08-13
公開日2021-04-28
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.21 Å)
主引用文献Structures of an engineered phospholipase D with specificity for secondary alcohol transphosphatidylation: insights into plasticity of substrate binding and activation.
Biochem.J., 478, 2021
7JRC
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BU of 7jrc by Molmil
Phospholipase D engineered mutant in complex with phosphate
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, GLYCEROL, PHOSPHATE ION, ...
著者Vrielink, A, Samantha, A.
登録日2020-08-12
公開日2021-04-28
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.01 Å)
主引用文献Structures of an engineered phospholipase D with specificity for secondary alcohol transphosphatidylation: insights into plasticity of substrate binding and activation.
Biochem.J., 478, 2021
6ETE
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BU of 6ete by Molmil
Crystal structure of KDM4D with tetrazolhydrazide compound 5
分子名称: 1,2-ETHANEDIOL, Lysine-specific demethylase 4D, NICKEL (II) ION, ...
著者Malecki, P.H, Weiss, M.S, Heinemann, U, Link, A.
登録日2017-10-26
公開日2019-02-20
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.468 Å)
主引用文献Crystal structure of KDM4D with tetrazolylhydrazide ligand NR128
To be published
6ETS
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BU of 6ets by Molmil
Crystal structure of KDM4D with tetrazolhydrazide compound 1
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Lysine-specific demethylase 4D, ...
著者Malecki, P.H, Link, A, Weiss, M.S, Heinemann, U.
登録日2017-10-27
公開日2019-02-20
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.333 Å)
主引用文献Structure-Based Screening of Tetrazolylhydrazide Inhibitors versus KDM4 Histone Demethylases.
Chemmedchem, 14, 2019
6F5R
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BU of 6f5r by Molmil
Crystal Structure of KDM4D with GF028 ligand
分子名称: 1,2-ETHANEDIOL, 2-(3-oxidanylpropylamino)pyridine-4-carboxylic acid, CHLORIDE ION, ...
著者Malecki, P.H, Link, A, Weiss, M.S, Heinemann, U.
登録日2017-12-02
公開日2018-12-12
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.607 Å)
主引用文献Crystal Structure of KDM4D with GF028 ligand
To be published
6F5S
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BU of 6f5s by Molmil
Crystal Structure of KDM4D with tetrazole ligand GF049
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Lysine-specific demethylase 4D, ...
著者Malecki, P.H, Link, A, Weiss, M.S, Heinemann, U.
登録日2017-12-02
公開日2018-12-12
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.48 Å)
主引用文献Crystal Structure of KDM4D with tetrazole ligand GF049
To be published
6ETT
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BU of 6ett by Molmil
Crystal structure of KDM4D with tetrazole compound 4
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Lysine-specific demethylase 4D, ...
著者Malecki, P.H, Link, A, Weiss, M.S, Heinemann, U.
登録日2017-10-27
公開日2019-02-20
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.257 Å)
主引用文献Structure-Based Screening of Tetrazolylhydrazide Inhibitors versus KDM4 Histone Demethylases.
Chemmedchem, 14, 2019
6ETV
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BU of 6etv by Molmil
Crystal structure of KDM4D with tetrazolhydrazide compound 2
分子名称: 1,2-ETHANEDIOL, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, CHLORIDE ION, ...
著者Malecki, P.H, Link, A, Weiss, M.S, Heinemann, U.
登録日2017-10-27
公開日2019-02-27
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.18 Å)
主引用文献Structure-Based Screening of Tetrazolylhydrazide Inhibitors versus KDM4 Histone Demethylases.
Chemmedchem, 14, 2019
6ETU
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BU of 6etu by Molmil
Crystal structure of KDM4D with tetrazolhydrazide compound 7
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Lysine-specific demethylase 4D, ...
著者Malecki, P.H, Link, A, Weiss, M.S, Heinemann, U.
登録日2017-10-27
公開日2019-02-20
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.33 Å)
主引用文献Structure-Based Screening of Tetrazolylhydrazide Inhibitors versus KDM4 Histone Demethylases.
Chemmedchem, 14, 2019
6ETW
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BU of 6etw by Molmil
Crystal structure of KDM4D with tetrazolhydrazide compound 3
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, GLYCEROL, ...
著者Malecki, P.H, Link, A, Weiss, M.S, Heinemann, U.
登録日2017-10-27
公開日2019-02-20
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献Structure-Based Screening of Tetrazolylhydrazide Inhibitors versus KDM4 Histone Demethylases.
Chemmedchem, 14, 2019
6F5Q
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BU of 6f5q by Molmil
Crystal Structure of KDM4D with GF026 ligand
分子名称: 1,2-ETHANEDIOL, 2-[2-(methylsulfonylamino)ethylamino]pyridine-4-carboxylic acid, CHLORIDE ION, ...
著者Malecki, P.H, Link, A, Weiss, M.S, Heinemann, U.
登録日2017-12-02
公開日2018-12-12
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.43 Å)
主引用文献Crystal Structure of KDM4D with GF026 ligand
To be published
6ETG
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BU of 6etg by Molmil
Crystal structure of KDM4D with tetrazolhydrazide compound 6
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Lysine-specific demethylase 4D, ...
著者Malecki, P.H, Link, A, Weiss, M.S, Heinemann, U.
登録日2017-10-26
公開日2019-02-20
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.279 Å)
主引用文献Structure-Based Screening of Tetrazolylhydrazide Inhibitors versus KDM4 Histone Demethylases.
Chemmedchem, 14, 2019
6F5T
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BU of 6f5t by Molmil
Crystal Structure of KDM4D with tetrazole ligand GF057
分子名称: 1,2-ETHANEDIOL, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Lysine-specific demethylase 4D, ...
著者Malecki, P.H, Link, A, Weiss, M.S, Heinemann, U.
登録日2017-12-02
公開日2018-12-12
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.58 Å)
主引用文献Crystal Structure of KDM4D with tetrazole ligand
To be published
6H10
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BU of 6h10 by Molmil
Crystal Structure of KDM4D with tetrazolylhydrazide ligand NR073
分子名称: 1,2-ETHANEDIOL, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, CHLORIDE ION, ...
著者Malecki, P.H, Weiss, M.S, Heinemann, U, Link, A.
登録日2018-07-10
公開日2020-01-29
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.104 Å)
主引用文献Crystal Structure of KDM4D with tetrazolylhydrazide ligand NR073
To be published
6H0Y
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BU of 6h0y by Molmil
Crystal Structure of KDM4D with tetrazolylhydrazide ligand NS022
分子名称: (2~{R})-3-(4-methoxyphenyl)-2-(2~{H}-1,2,3,4-tetrazol-5-yl)propanehydrazide, 1,2-ETHANEDIOL, Lysine-specific demethylase 4D, ...
著者Malecki, P.H, Weiss, M.S, Heinemann, U, Link, A.
登録日2018-07-10
公開日2020-01-29
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.212 Å)
主引用文献Crystal Structure of KDM4D with tetrazolylhydrazide ligand NS022
To be published
6H0Z
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BU of 6h0z by Molmil
Crystal Structure of KDM4D with tetrazolylhydrazide ligand NR067
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Lysine-specific demethylase 4D, ...
著者Malecki, P.H, Weiss, M.S, Heinemann, U, Link, A.
登録日2018-07-10
公開日2020-01-29
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.34 Å)
主引用文献Crystal Structure of KDM4D with tetrazolylhydrazide ligand NR067
To be published
6H0X
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BU of 6h0x by Molmil
Crystal Structure of KDM4D with tetrazolylhydrazide ligand AA040
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Lysine-specific demethylase 4D, ...
著者Malecki, P.H, Weiss, M.S, Heinemann, U, Link, A.
登録日2018-07-10
公開日2020-01-29
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.64 Å)
主引用文献Crystal Structure of KDM4D with tetrazolylhydrazide ligand AA040
To be published
6H11
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BU of 6h11 by Molmil
Crystal Structure of KDM4D with tetrazolylhydrazide ligand AA028
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Lysine-specific demethylase 4D, ...
著者Malecki, P.H, Weiss, M.S, Heinemann, U, Link, A.
登録日2018-07-10
公開日2020-01-29
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.516 Å)
主引用文献Crystal Structure of KDM4D with tetrazolylhydrazide ligand AA028
To be published
6H0W
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BU of 6h0w by Molmil
Crystal Structure of KDM4D with tetrazolylhydrazide ligand NS035
分子名称: (2~{R})-3-phenyl-2-(2~{H}-1,2,3,4-tetrazol-5-yl)propanehydrazide, 1,2-ETHANEDIOL, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ...
著者Malecki, P.H, Weiss, M.S, Heinemann, U, Link, A.
登録日2018-07-10
公開日2020-01-29
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.23 Å)
主引用文献Crystal Structure of KDM4D with tetrazolylhydrazide ligand NS035
To be published
4U2S
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BU of 4u2s by Molmil
Cholesterol oxidase in the reduced state complexed with isopropanol
分子名称: Cholesterol oxidase, DIHYDROFLAVINE-ADENINE DINUCLEOTIDE, SULFATE ION
著者Golden, E.A, Vrielink, A.
登録日2014-07-18
公開日2014-12-10
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (1.12 Å)
主引用文献High-resolution structures of cholesterol oxidase in the reduced state provide insights into redox stabilization.
Acta Crystallogr.,Sect.D, 70, 2014
4U2T
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BU of 4u2t by Molmil
Cholesterol oxidase in the oxidised state complexed with isopropanol
分子名称: Cholesterol oxidase, FLAVIN-ADENINE DINUCLEOTIDE, SULFATE ION
著者Golden, E.A, Vrielink, A.
登録日2014-07-18
公開日2014-12-10
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.223 Å)
主引用文献High-resolution structures of cholesterol oxidase in the reduced state provide insights into redox stabilization.
Acta Crystallogr.,Sect.D, 70, 2014
4U2L
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BU of 4u2l by Molmil
Dithionite reduced cholesterol in complex with sulfite
分子名称: (S)-10-((2S,3S,4R)-5-((S)-((S)-(((2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXY-TETRAHYDROFURAN-2-YL)METHOXY)(HYDROXY)PHOSPHORYLOXY)(HYDROXY)PHOSPHORYLOXY)-2,3,4-TRIHYDROXYPENTYL)-7,8-DIMETHYL-2,4-DIOXO-2,3,4,4A-TETRAHYDROBENZO[G]PTERIDINE-5(10H)-SULFONIC ACID, Cholesterol oxidase, SULFATE ION
著者Golden, E.A, Vrielink, A.
登録日2014-07-17
公開日2014-12-10
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.337 Å)
主引用文献High-resolution structures of cholesterol oxidase in the reduced state provide insights into redox stabilization.
Acta Crystallogr.,Sect.D, 70, 2014
8F2G
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BU of 8f2g by Molmil
Crystal structure of Hen Egg White Lysozyme at 0.44 GPa
分子名称: Lysozyme C
著者Marshall, A.C, Boer, S.A, Turner, G, Moggach, S.A, Bond, C.S, Vrielink, A.
登録日2022-11-08
公開日2022-12-07
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (1.84 Å)
主引用文献High-pressure single-crystal diffraction at the Australian Synchrotron.
J.Synchrotron Radiat., 30, 2023
1I19
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BU of 1i19 by Molmil
CRYSTAL STRUCTURE OF CHOLESTEROL OXIDASE FROM B.STEROLICUM
分子名称: 1,2-ETHANEDIOL, CACODYLATE ION, CHOLESTEROL OXIDASE, ...
著者Coulombe, R, Yue, K.Q, Ghisla, S, Vrielink, A.
登録日2001-01-31
公開日2001-08-08
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Oxygen access to the active site of cholesterol oxidase through a narrow channel is gated by an Arg-Glu pair.
J.Biol.Chem., 276, 2001

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