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8F5J
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BU of 8f5j by Molmil
human branched chain ketoacid dehydrogenase kinase in complex with inhibitors
分子名称: 3-chloro-5-fluorothieno[3,2-b]thiophene-2-carboxylic acid, ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
著者Liu, S, Roth Flach, R, Bollinger, E, Filipski, K.
登録日2022-11-14
公開日2023-07-05
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.545 Å)
主引用文献Small molecule branched-chain ketoacid dehydrogenase kinase (BDK) inhibitors with opposing effects on BDK protein levels.
Nat Commun, 14, 2023
8F5S
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BU of 8f5s by Molmil
human branched chain ketoacid dehydrogenase kinase in complex with inhibitors
分子名称: (2M)-2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]benzoic acid, ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
著者Liu, S, Roth Flach, R, Bollinger, E, Filipski, K.
登録日2022-11-15
公開日2023-07-05
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2.793 Å)
主引用文献Small molecule branched-chain ketoacid dehydrogenase kinase (BDK) inhibitors with opposing effects on BDK protein levels.
Nat Commun, 14, 2023
1PIW
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BU of 1piw by Molmil
APO AND HOLO STRUCTURES OF AN NADP(H)-DEPENDENT CINNAMYL ALCOHOL DEHYDROGENASE FROM SACCHAROMYCES CEREVISIAE
分子名称: Hypothetical zinc-type alcohol dehydrogenase-like protein in PRE5-FET4 intergenic region, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ZINC ION
著者Valencia, E, Larroy, C, Ochoa, W.F, Pares, X, Fita, I, Biosca, J.A.
登録日2003-05-30
公開日2004-08-10
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Apo and Holo Structures of an NADP(H)-dependent Cinnamyl Alcohol Dehydrogenase from Saccharomyces cerevisiae
J.Mol.Biol., 341, 2004
2NOM
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BU of 2nom by Molmil
Terminal uridylyl transferase 4 from Trypanosoma brucei with bound dUTP
分子名称: DEOXYURIDINE-5'-TRIPHOSPHATE, MAGNESIUM ION, RNA uridylyl transferase
著者Luecke, H, Stagno, J.
登録日2006-10-25
公開日2007-02-20
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献UTP-bound and Apo Structures of a Minimal RNA Uridylyltransferase.
J.Mol.Biol., 366, 2007
2PAF
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BU of 2paf by Molmil
Crystal Structure of the Lactose Repressor bound to anti-inducer ONPF in induced state
分子名称: 2-nitrophenyl beta-D-fucopyranoside, Lactose operon repressor
著者Daber, R.
登録日2007-03-27
公開日2007-06-19
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (3.5 Å)
主引用文献Structural analysis of lac repressor bound to allosteric effectors.
J.Mol.Biol., 370, 2007
6UL7
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BU of 6ul7 by Molmil
Structure of human ketohexokinase-C in complex with fructose, NO3, and osthole
分子名称: 7-methoxy-8-(3-methylbut-2-enyl)chromen-2-one, Ketohexokinase, NITRATE ION, ...
著者Gasper, W.C, Gardner, S, Allen, K.N, Tolan, D.R.
登録日2019-10-07
公開日2021-04-07
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structure of human ketohexokinase-C in complex with fructose, NO3, and osthole
To be Published
7JOU
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BU of 7jou by Molmil
CRYSTAL STRUCTURE OF RHO-ASSOCIATED PROTEIN KINASE 1 (ROCK1) IN COMPLEX WITH A PHENYLPYRAZOLE AMIDE INHIBITOR
分子名称: N-[(1S)-2-hydroxy-1-phenylethyl]-3-methoxy-4-(1H-pyrazol-4-yl)benzamide, Rho-associated protein kinase 1
著者Muckelbauer, J.K.
登録日2020-08-07
公開日2020-09-02
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (3.318 Å)
主引用文献Discovery of a phenylpyrazole amide ROCK inhibitor as a tool molecule for in vivo studies.
Bioorg.Med.Chem.Lett., 30, 2020
7JOV
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BU of 7jov by Molmil
CRYSTAL STRUCTURE OF RHO-ASSOCIATED PROTEIN KINASE 2 (ROCK2) IN COMPLEX WITH A PHENYLPYRAZOLE AMIDE INHIBITOR
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CHLORIDE ION, N-[(1S)-2-hydroxy-1-phenylethyl]-3-methoxy-4-(1H-pyrazol-4-yl)benzamide, ...
著者Muckelbauer, J.K.
登録日2020-08-07
公開日2020-09-02
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.586 Å)
主引用文献Discovery of a phenylpyrazole amide ROCK inhibitor as a tool molecule for in vivo studies.
Bioorg.Med.Chem.Lett., 30, 2020
1PS0
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BU of 1ps0 by Molmil
Crystal Structure of the NADP(H)-Dependent Cinnamyl Alcohol Dehydrogenase from Saccharomyces cerevisiae
分子名称: Hypothetical zinc-type alcohol dehydrogenase-like protein in PRE5-FET4 intergenic region, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ZINC ION
著者Valencia, E, Larroy, C, Ochoa, W.F, Pares, X, Fita, I, Biosca, J.A.
登録日2003-06-20
公開日2004-06-29
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (3.01 Å)
主引用文献Apo and Holo Structures of an NADP(H)-dependent Cinnamyl Alcohol Dehydrogenase from Saccharomyces cerevisiae
J.Mol.Biol., 341, 2004
1Q1N
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BU of 1q1n by Molmil
APO AND HOLO STRUCTURES OF AN NADP(H)-DEPENDENT CINNAMYL ALCOHOL DEHYDROGENASE FROM SACCHAROMYCES CEREVISIAE
分子名称: Hypothetical zinc-type alcohol dehydrogenase-like protein in PRE5-FET4 intergenic region, ZINC ION
著者Valencia, E, Larroy, C, Ochoa, W.F, Pares, X, Fita, I, Biosca, J.A.
登録日2003-07-22
公開日2004-08-03
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (3.15 Å)
主引用文献Apo and Holo Structures of an NADP(H)-dependent Cinnamyl Alcohol Dehydrogenase from Saccharomyces cerevisiae
J.Mol.Biol., 341, 2004
2P9H
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BU of 2p9h by Molmil
High resolution structure of the Lactose Repressor bound to IPTG
分子名称: 1-methylethyl 1-thio-beta-D-galactopyranoside, Lactose operon repressor
著者Daber, R.
登録日2007-03-26
公開日2007-06-19
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structural analysis of lac repressor bound to allosteric effectors.
J.Mol.Biol., 370, 2007
2IKF
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BU of 2ikf by Molmil
Terminal uridylyl transferase 4 from Trypanosoma brucei with bound UTP
分子名称: MAGNESIUM ION, RNA uridylyl transferase, URIDINE 5'-TRIPHOSPHATE
著者Luecke, H, Stagno, J.
登録日2006-10-02
公開日2007-02-20
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献UTP-bound and Apo Structures of a Minimal RNA Uridylyltransferase.
J.Mol.Biol., 366, 2007
2H2Q
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BU of 2h2q by Molmil
Crystal structure of Trypanosoma cruzi Dihydrofolate Reductase-Thymidylate synthase
分子名称: 2'-DEOXYURIDINE-5'-MONOPHOSPHATE, Bifunctional dihydrofolate reductase-thymidylate synthase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
著者Senkovich, O, Schormann, N, Chattopadhyay, D.
登録日2006-05-19
公開日2008-04-08
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structure-based approach to pharmacophore identification, in silico screening, and three-dimensional quantitative structure-activity relationship studies for inhibitors of Trypanosoma cruzi dihydrofolate reductase function.
Proteins, 73, 2008
2LTK
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BU of 2ltk by Molmil
Solution structure of a monomeric truncated mutant of Trypanosoma brucei 1-C-Grx1
分子名称: Mono-cysteine glutaredoxin
著者Pavan, C, Gesiot, L, Sturlese, M, Mammi, S, Manta, B, Comini, M, Bellanda, M.
登録日2012-05-29
公開日2013-05-08
最終更新日2024-05-01
実験手法SOLUTION NMR
主引用文献Iron-Sulfur Cluster Binding by Mitochondrial Monothiol Glutaredoxin-1 of Trypanosoma brucei: Molecular Basis of Iron-Sulfur Cluster Coordination and Relevance for Parasite Infectivity.
Antioxid Redox Signal, 19, 2013
2GIW
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BU of 2giw by Molmil
SOLUTION STRUCTURE OF REDUCED HORSE HEART CYTOCHROME C, NMR, 40 STRUCTURES
分子名称: CYTOCHROME C, HEME C
著者Banci, L, Bertini, I, Huber, J.G, Spyroulias, G.A, Turano, P.
登録日1998-06-25
公開日1998-12-09
最終更新日2022-03-09
実験手法SOLUTION NMR
主引用文献Solution structure of reduced horse heart cytochrome c.
J.Biol.Inorg.Chem., 4, 1999

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