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PDB: 79 件
8CFE
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BU of 8cfe by Molmil
Crystal structure of S-adenosyl-L-homocysteine hydrolase from P. aeruginosa in complex with F2X-Entry library fragment B03
分子名称: 2-[(1R)-1-aminopropyl]phenol, ADENINE, Adenosylhomocysteinase, ...
著者Malecki, P.H, Gawel, M, Stepniewska, M, Brzezinski, K.
登録日2023-02-03
公開日2024-02-21
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal structure of S-adenosyl-L-homocysteine hydrolase from P. aeruginosa in complex with fragment F2X-Entry B03
To be published
8CFC
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BU of 8cfc by Molmil
Crystal structure of S-adenosyl-L-homocysteine hydrolase from P. aeruginosa in complex with F2X-Entry library fragment A01
分子名称: ADENINE, Adenosylhomocysteinase, DIMETHYL SULFOXIDE, ...
著者Malecki, P.H, Gawel, M, Stepniewska, M, Brzezinski, K.
登録日2023-02-03
公開日2024-02-21
実験手法X-RAY DIFFRACTION (1.64 Å)
主引用文献Crystal structure of S-adenosyl-L-homocysteine hydrolase from P. aeruginosa in complex with fragment F2X-Entry A01
To be published
8CFQ
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BU of 8cfq by Molmil
Crystal structure of S-adenosyl-L-homocysteine hydrolase from P. aeruginosa in complex with F2X-Entry library fragment F11
分子名称: 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE, ADENINE, Adenosylhomocysteinase, ...
著者Malecki, P.H, Gawel, M, Stepniewska, M, Brzezinski, K.
登録日2023-02-03
公開日2024-02-21
実験手法X-RAY DIFFRACTION (1.73 Å)
主引用文献Crystal structure of S-adenosyl-L-homocysteine hydrolase from P. aeruginosa in complex with fragment F2X-Entry F11
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
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
6F5Q
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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
6H10
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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
6G5W
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BU of 6g5w by Molmil
Crystal Structure of KDM4A with compound YP-03-038
分子名称: (4~{R})-5-methyl-4-phenyl-2-pyridin-2-yl-pyrazolidin-3-one, 1,2-ETHANEDIOL, CITRIC ACID, ...
著者Malecki, P.H, Carter, D.M, Gohlke, U, Specker, E, Nazare, M, Weiss, M.S, Heinemann, U.
登録日2018-03-30
公開日2019-04-10
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.83 Å)
主引用文献Enhanced Properties of a Benzimidazole Benzylpyrazole Lysine Demethylase Inhibitor: Mechanism-of-Action, Binding Site Analysis, and Activity in Cellular Models of Prostate Cancer.
J.Med.Chem., 64, 2021
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
6G5X
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BU of 6g5x by Molmil
Crystal Structure of KDM4A with compound YP-02-145
分子名称: 1,2-ETHANEDIOL, 2-(3-methyl-5-oxidanylidene-4-phenyl-4~{H}-pyrazol-1-yl)-3~{H}-benzimidazole-5-carboxylic acid, CITRIC ACID, ...
著者Malecki, P.H, Carter, D.M, Gohlke, U, Specker, E, Nazare, M, Weiss, M.S, Heinemann, U.
登録日2018-03-30
公開日2019-04-10
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.78 Å)
主引用文献Enhanced Properties of a Benzimidazole Benzylpyrazole Lysine Demethylase Inhibitor: Mechanism-of-Action, Binding Site Analysis, and Activity in Cellular Models of Prostate Cancer.
J.Med.Chem., 64, 2021
6G9E
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BU of 6g9e by Molmil
Crystal structure of immunomodulatory active chitinase from Trichuris suis - TsES1 - 6 molecules in ASU
分子名称: 1,2-ETHANEDIOL, Immunomodulatory active chitinase
著者Malecki, P.H, Balster, K, Hartmann, S, Weiss, M.S, Heinemann, U.
登録日2018-04-10
公開日2019-04-24
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.69 Å)
主引用文献A Helminth-Derived Chitinase Structurally Similar to Mammalian Chitinase Displays Immunomodulatory Properties in Inflammatory Lung Disease.
J Immunol Res, 2021, 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
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
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
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
6H0Z
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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
6G9C
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BU of 6g9c by Molmil
Crystal structure of immunomodulatory active chitinase from Trichuris suis, TsES1
分子名称: 1,2-ETHANEDIOL, Immunomodulatory active chitinase
著者Malecki, P.H, Balster, K, Hartmann, S, Weiss, M.S, Heinemann, U.
登録日2018-04-10
公開日2019-04-24
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.74 Å)
主引用文献A Helminth-Derived Chitinase Structurally Similar to Mammalian Chitinase Displays Immunomodulatory Properties in Inflammatory Lung Disease.
J Immunol Res, 2021, 2021
6ZQ8
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BU of 6zq8 by Molmil
Crystal structure of Chaetomium thermophilum Glycerol Kinase in P3221 space group
分子名称: Glycerol kinase-like protein
著者Wilk, P, Wator, E, Malecki, P, Tokarz, P, Grudnik, P.
登録日2020-07-09
公開日2020-12-23
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.38 Å)
主引用文献Structural Characterization of Glycerol Kinase from the Thermophilic Fungus Chaetomium thermophilum .
Int J Mol Sci, 21, 2020
6ZQ5
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BU of 6zq5 by Molmil
Crystal structure of Chaetomium thermophilum Glycerol Kinase in P2221 space group
分子名称: 1,2-ETHANEDIOL, Glycerol kinase-like protein
著者Wilk, P, Wator, E, Malecki, P, Grudnik, P.
登録日2020-07-09
公開日2020-12-23
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.14 Å)
主引用文献Structural Characterization of Glycerol Kinase from the Thermophilic Fungus Chaetomium thermophilum .
Int J Mol Sci, 21, 2020
8AJW
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BU of 8ajw by Molmil
Crystal structure of the Q65N mutant of S-adenosyl-L-homocysteine hydrolase from Pseudomonas aeruginosa cocrystallized with adenosine in the presence of K+ cations
分子名称: ADENOSINE, DI(HYDROXYETHYL)ETHER, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ...
著者Drozdzal, P, Wozniak, K, Malecki, P, Gawel, M, Komorowska, M, Brzezinski, K.
登録日2022-07-28
公開日2023-08-16
実験手法X-RAY DIFFRACTION (1.819 Å)
主引用文献Crystal structure of the Q65N mutant of S-adenosyl-L-homocysteine hydrolase from Pseudomonas aeruginosa cocrystallized with adenosine in the presence of K+ cations
To Be Published
8AJV
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Crystal structure of the Q65N mutant of S-adenosyl-L-homocysteine hydrolase from Pseudomonas aeruginosa crystallized in the presence of K+ cations
分子名称: Adenosylhomocysteinase, DI(HYDROXYETHYL)ETHER, GLYCEROL, ...
著者Drozdzal, P, Wozniak, K, Malecki, P, Gawel, M, Komorowska, M, Brzezinski, K.
登録日2022-07-28
公開日2023-08-16
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Crystal structure of the Q65N mutant of S-adenosyl-L-homocysteine hydrolase from Pseudomonas aeruginosa crystallized in the presence of K+ cations
To Be Published

221051

件を2024-06-12に公開中

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