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8GOL
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BU of 8gol by Molmil
crystal structure of SulE
分子名称: 2-[(4-chloranyl-6-methoxy-pyrimidin-2-yl)carbamoylsulfamoyl]benzoic acid, Alpha/beta fold hydrolase, GLYCEROL
著者Liu, B, Ran, T, Wang, W, He, J.
登録日2022-08-25
公開日2023-08-02
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Crystal structures of herbicide-detoxifying esterase reveal a lid loop affecting substrate binding and activity.
Nat Commun, 14, 2023
8GP0
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BU of 8gp0 by Molmil
crystal structure of SulE
分子名称: Alpha/beta fold hydrolase, CITRIC ACID, GLYCEROL
著者Liu, B, Ran, T, wang, W, He, J.
登録日2022-08-25
公開日2023-08-02
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (1.46 Å)
主引用文献Crystal structures of herbicide-detoxifying esterase reveal a lid loop affecting substrate binding and activity.
Nat Commun, 14, 2023
8HEH
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BU of 8heh by Molmil
Crystal structure of GCN5-related N-acetyltransferase 05790
分子名称: COENZYME A, GLYCEROL, GNAT family N-acetyltransferase
著者Xu, M.X, Ran, T.T, Wang, W.
登録日2022-11-08
公開日2022-12-21
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Crystal structure of prodigiosin binding protein PgbP, a GNAT family protein, in Serratia marcescens FS14.
Biochem.Biophys.Res.Commun., 640, 2022
6XDF
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BU of 6xdf by Molmil
Crystal structure of IRE1a in complex with G-4100
分子名称: 4-amino-N-(6-chloro-2-fluoro-3-{[(pyrrolidin-1-yl)sulfonyl]amino}phenyl)quinazoline-8-carboxamide, SODIUM ION, Serine/threonine-protein kinase/endoribonuclease IRE1
著者Steinbacher, S, Wang, W.
登録日2020-06-10
公開日2021-04-21
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.54 Å)
主引用文献Identification of BRaf-Sparing Amino-Thienopyrimidines with Potent IRE1 alpha Inhibitory Activity.
Acs Med.Chem.Lett., 11, 2020
6XDD
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BU of 6xdd by Molmil
Crystal structure of IRE1 in complex with G-3053
分子名称: 4-[(trans-4-aminocyclohexyl)amino]-N-(6-chloro-3-{[(2,5-difluorophenyl)sulfonyl]amino}-2-fluorophenyl)thieno[3,2-d]pyrimidine-7-carboxamide, Serine/threonine-protein kinase/endoribonuclease IRE1
著者Ackerly-Wallweber, H, Wang, W.
登録日2020-06-10
公開日2021-04-21
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Identification of BRaf-Sparing Amino-Thienopyrimidines with Potent IRE1 alpha Inhibitory Activity.
Acs Med.Chem.Lett., 11, 2020
8H0M
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BU of 8h0m by Molmil
Crystal structure of VioD
分子名称: (2S)-2-ethylhexan-1-ol, FLAVIN-ADENINE DINUCLEOTIDE, FORMIC ACID, ...
著者Xu, M, Ran, T, Wang, W.
登録日2022-09-29
公開日2023-04-12
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.702 Å)
主引用文献Structural basis for substrate binding and catalytic mechanism of the key enzyme VioD in the violacein synthesis pathway.
Proteins, 91, 2023
8V0C
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BU of 8v0c by Molmil
Structure of TDP1 catalytic domain complexed with compound IB06
分子名称: (8M)-8-(2-{[2-(fluorosulfonyl)ethyl]amino}phenyl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, ...
著者Lountos, G.T, Zhao, X.Z, Barakat, I, Wang, W, Agama, K, Al Mahmud, M.R, Pommier, Y, Burke Jr, T.R.
登録日2023-11-17
公開日2024-09-25
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (1.62 Å)
主引用文献Structures of TDP1 complexed with inhibitors
To Be Published
8UZZ
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BU of 8uzz by Molmil
Structure of TDP1 catalytic domain complexed with compound IB03
分子名称: (8M)-8-{2-[(fluorosulfonyl)oxy]phenyl}-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, ...
著者Lountos, G.T, Zhao, X.Z, Barakat, I, Wang, W, Agama, K, Al Mahmud, M.R, Pommier, Y, Burke Jr, T.R.
登録日2023-11-16
公開日2024-09-25
実験手法X-RAY DIFFRACTION (1.93 Å)
主引用文献Structureal analysis of TDP1 in complex with inhbitors
To Be Published
8V0B
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BU of 8v0b by Molmil
Structure of TDP1 catalytic domain complexed with compound IB05
分子名称: 1,2-ETHANEDIOL, 8-{4-[(fluorosulfonyl)oxy]phenyl}-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, DI(HYDROXYETHYL)ETHER, ...
著者Lountos, G.T, Zhao, X.Z, Barakat, I, Wang, W, Agama, K, Al Mahmud, M.R, Pommier, Y, Burke Jr, T.R.
登録日2023-11-17
公開日2024-09-25
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Structures of TDP1 complexed with inhibitors
To Be Published
8H4E
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BU of 8h4e by Molmil
Blasnase-T13A/P55N with D-asn
分子名称: D-ASPARAGINE, FORMIC ACID, L-asparaginase, ...
著者Lu, F, Wang, W, Chi, H, Ran, T.
登録日2022-10-10
公開日2023-10-18
実験手法X-RAY DIFFRACTION (2.06 Å)
主引用文献Structure-based rational design of Bacillus licheniformis L-asparaginase with low/no D-asparaginase activity for a safer enzyme
To Be Published
8UV1
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BU of 8uv1 by Molmil
Structure of TDP1 complexed with compound IB01
分子名称: 1,2-ETHANEDIOL, 8-(fluorosulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, Tyrosyl-DNA phosphodiesterase 1
著者Lountos, G.T, Zhao, X.Z, Barakat, I, Wang, W, Agama, K, Al Mahmud, M.R, Pommier, Y, Burke, T.R.
登録日2023-11-02
公開日2024-09-25
実験手法X-RAY DIFFRACTION (1.83 Å)
主引用文献Structure of TDP1 complexed with compound IB01
To Be Published
8UZV
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BU of 8uzv by Molmil
Structure of TDP1 catalytic domain complexed with compound IB02
分子名称: 1,2-ETHANEDIOL, 8-{[2-(fluorosulfonyl)ethyl]amino}-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, DI(HYDROXYETHYL)ETHER, ...
著者Lountos, G.T, Zhao, X.Z, Barakat, I, Wang, W, Agama, K, Al Mahmud, M.R, Pommier, Y, Burke Jr, T.R.
登録日2023-11-16
公開日2024-09-25
実験手法X-RAY DIFFRACTION (1.846 Å)
主引用文献Structure of TDP1 catalytic domain complexed with compound IB02
To Be Published
8H46
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BU of 8h46 by Molmil
Blasnase-T13A/P55N with L-asn
分子名称: ASPARAGINE, FORMIC ACID, GLYCEROL, ...
著者Lu, F, Wang, W, Chi, H, Ran, T.
登録日2022-10-10
公開日2023-10-18
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structure-based rational design of Bacillus licheniformis L-asparaginase with low/no D-asparaginase activity for a safer enzyme
To Be Published
8H47
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BU of 8h47 by Molmil
Blasnase-T13A/P55F
分子名称: FORMIC ACID, GLYCEROL, L-asparaginase, ...
著者Lu, F, Wang, W, Chi, H, Ran, T.
登録日2022-10-10
公開日2023-10-18
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structure-based rational design of Bacillus licheniformis L-asparaginase with low/no D-asparaginase activity for a safer enzyme
To Be Published
8H4B
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BU of 8h4b by Molmil
Blasnase-T13A/M57P with L-asn
分子名称: ASPARAGINE, FORMIC ACID, L-asparaginase, ...
著者Lu, F, Wang, W, Chi, H, Ran, T.
登録日2022-10-10
公開日2023-10-18
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structure-based rational design of Bacillus licheniformis L-asparaginase with low/no D-asparaginase activity for a safer enzyme
To Be Published
8H4D
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BU of 8h4d by Molmil
Blasnase-T13A/M57N
分子名称: FORMIC ACID, GLYCEROL, L-asparaginase, ...
著者Lu, F, Wang, W, Chi, H, Ran, T.
登録日2022-10-10
公開日2023-10-18
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structure-based rational design of Bacillus licheniformis L-asparaginase with low/no D-asparaginase activity for a safer enzyme
To Be Published
8H44
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BU of 8h44 by Molmil
Blasnase-P55N
分子名称: FORMIC ACID, L-asparaginase, MAGNESIUM ION
著者Lu, F, Wang, W, Chi, H, Ran, T.
登録日2022-10-10
公開日2023-10-18
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structure-based rational design of Bacillus licheniformis L-asparaginase with low/no D-asparaginase activity for a safer enzyme
To Be Published
8H45
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BU of 8h45 by Molmil
Blasnase-T13A/P55N
分子名称: FORMIC ACID, L-asparaginase, MAGNESIUM ION
著者Lu, F, Wang, W, Chi, H, Ran, T.
登録日2022-10-10
公開日2023-10-18
実験手法X-RAY DIFFRACTION (1.97 Å)
主引用文献Structure-based rational design of Bacillus licheniformis L-asparaginase with low/no D-asparaginase activity for a safer enzyme
To Be Published
8H48
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BU of 8h48 by Molmil
Blasnase-T13A/P55F with L-asn
分子名称: ASPARAGINE, FORMIC ACID, L-asparaginase, ...
著者Lu, F, Wang, W, Chi, H, Ran, T.
登録日2022-10-10
公開日2023-10-18
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structure-based rational design of Bacillus licheniformis L-asparaginase with low/no D-asparaginase activity for a safer enzyme
To Be Published
8H49
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BU of 8h49 by Molmil
Blasnase-M57P
分子名称: FORMIC ACID, L-asparaginase, MAGNESIUM ION
著者Lu, F, Wang, W, Chi, H, Ran, T.
登録日2022-10-10
公開日2023-10-18
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structure-based rational design of Bacillus licheniformis L-asparaginase with low/no D-asparaginase activity for a safer enzyme
To Be Published
8H4A
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BU of 8h4a by Molmil
Blasnase-T13A/M57P
分子名称: FORMIC ACID, L-asparaginase, MAGNESIUM ION
著者Lu, F, Wang, W, Chi, H, Ran, T.
登録日2022-10-10
公開日2023-10-18
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structure-based rational design of Bacillus licheniformis L-asparaginase with low/no D-asparaginase activity for a safer enzyme
To Be Published
8H4C
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BU of 8h4c by Molmil
Blasnase-T13A/M57P
分子名称: FORMIC ACID, L-asparaginase, MAGNESIUM ION
著者Lu, F, Wang, W, Chi, H, Ran, T.
登録日2022-10-10
公開日2023-10-18
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Structure-based rational design of Bacillus licheniformis L-asparaginase with low/no D-asparaginase activity for a safer enzyme
To Be Published
8H4G
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BU of 8h4g by Molmil
Blasnase-T13A/M57N
分子名称: FORMIC ACID, L-asparaginase, MAGNESIUM ION
著者Lu, F, Wang, W, Chi, H, Ran, T.
登録日2022-10-10
公開日2023-10-18
実験手法X-RAY DIFFRACTION (1.81 Å)
主引用文献Structure-based rational design of Bacillus licheniformis L-asparaginase with low/no D-asparaginase activity for a safer enzyme
To Be Published
8H4F
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BU of 8h4f by Molmil
Blasnase-T13A/P55F with D-asn
分子名称: D-ASPARAGINE, FORMIC ACID, L-asparaginase, ...
著者Lu, F, Wang, W, Chi, H, Ran, T.
登録日2022-10-10
公開日2023-11-08
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structure-based rational design of Bacillus licheniformis L-asparaginase with low/no D-asparaginase activity for a safer enzyme
To Be Published
8GQR
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BU of 8gqr by Molmil
Crystal structure of VioD with FAD
分子名称: FLAVIN-ADENINE DINUCLEOTIDE, GLYCEROL, SULFATE ION, ...
著者Ran, T, Wang, W, Xu, M.
登録日2022-08-30
公開日2023-03-29
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structural basis for substrate binding and catalytic mechanism of the key enzyme VioD in the violacein synthesis pathway.
Proteins, 91, 2023

226707

件を2024-10-30に公開中

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