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4USZ
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BU of 4usz by Molmil
Crystal structure of the first bacterial vanadium dependant iodoperoxidase
分子名称: SODIUM ION, VANADATE ION, VANADIUM-DEPENDENT HALOPEROXIDASE
著者Rebuffet, E, Delage, L, Fournier, J.B, Rzonca, J, Potin, P, Michel, G, Czjzek, M, Leblanc, C.
登録日2014-07-17
公開日2014-10-08
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献The Bacterial Vanadium Iodoperoxidase from the Marine Flavobacteriaceae Zobellia Galactanivorans Reveals Novel Molecular and Evolutionary Features of Halide Specificity in This Enzyme Family.
Appl.Environ.Microbiol., 80, 2014
5AA6
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Homohexameric Structure of the second Vanadate-Dependent Bromoperoxidase (AnII) from Ascophyllum nodosum
分子名称: VANADATE ION, VANADIUM-DEPENDENT BROMOPEROXIDASE 2
著者Radlow, M, Jeudy, A, Dabin, J, Delage, L, Leblanc, C, Hartung, J, Czjzek, M.
登録日2015-07-23
公開日2016-08-03
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.26 Å)
主引用文献Homohexameric Structure of the Second Vanadate Dependant Bromoperoxidase from Ascophyllum Nodosum
To be Published
7QNM
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BU of 7qnm by Molmil
Crystallization and structural analyses of ZgHAD, a L-2-haloacid dehalogenase from the marine Flavobacterium Zobellia galactanivorans
分子名称: (S)-2-haloacid dehalogenase, PHOSPHATE ION
著者Grigorian, E, Roret, T, Leblanc, C, Delage, L, Czjzek, M.
登録日2021-12-21
公開日2022-12-21
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.73 Å)
主引用文献X-ray structure and mechanism of ZgHAD, a l-2-haloacid dehalogenase from the marine Flavobacterium Zobellia galactanivorans.
Protein Sci., 32, 2023
4B0N
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BU of 4b0n by Molmil
Crystal structure of PKS-I from the brown algae Ectocarpus siliculosus
分子名称: ARACHIDONIC ACID, MALONIC ACID, POLYKETIDE SYNTHASE III
著者Leroux, C, Meslet-Cladiere, L, Delage, L, Goulitquer, S, Leblanc, C, Ar Gall, E, Stiger-Pouvreau, V, Potin, P, Czjzek, M.
登録日2012-07-03
公開日2013-07-10
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.85 Å)
主引用文献Structure/Function Analysis of a Type III Polyketide Synthase in the Brown Alga Ectocarpus Siliculosus Reveals a Biochemical Pathway in Phlorotannin Monomer Biosynthesis.
Plant Cell, 25, 2013
7ARP
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BU of 7arp by Molmil
Native L-2-haloacid dehalogenase from Zobellia galactanivorans
分子名称: (S)-2-haloacid dehalogenase, PHOSPHATE ION, THIOCYANATE ION
著者Grigorian, E, Roret, T, Czjzek, M, Leblanc, C, Delage, L.
登録日2020-10-26
公開日2021-09-08
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.78 Å)
主引用文献X-ray structure and mechanism of ZgHAD, a L-2-haloacid dehalogenase from the marine Flavobacterium Zobellia galactanivorans.
Protein Sci., 2022
7ASZ
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BU of 7asz by Molmil
L-2-haloacid dehalogenase H190A mutant from Zobellia galactanivorans
分子名称: (S)-2-haloacid dehalogenase, PHOSPHATE ION, THIOCYANATE ION
著者Grigorian, E, Roret, T, Czjzek, M, Leblanc, C, Delage, L.
登録日2020-10-28
公開日2021-09-08
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.88 Å)
主引用文献X-ray structure and mechanism of ZgHAD, a L-2-haloacid dehalogenase from the marine Flavobacterium Zobellia galactanivorans.
Protein Sci., 2022
4CIT
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BU of 4cit by Molmil
Crystal structure of the first bacterial vanadium dependant iodoperoxidase
分子名称: SODIUM ION, VANADATE ION, VANADIUM-DEPENDENT HALOPEROXIDASE
著者Rebuffet, E, Delage, L, Fournier, J.B, Rzonca, J, Potin, P, Michel, G, Czjzek, M, Leblanc, C.
登録日2013-12-16
公開日2014-10-08
最終更新日2020-06-03
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献The Bacterial Vanadium Iodoperoxidase from the Marine Flavobacteriaceae Zobellia Galactanivorans Reveals Novel Molecular and Evolutionary Features of Halide Specificity in This Enzyme Family.
Appl.Environ.Microbiol., 80, 2014
6YI8
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BU of 6yi8 by Molmil
HUMAN FGFR4 KINASE DOMAIN (447-753) IN COMPLEX WITH ROBLITINIB
分子名称: Fibroblast growth factor receptor 4, N-[5-cyano-4-(2-methoxyethylamino)pyridin-2-yl]-7-methanoyl-6-[(4-methyl-2-oxidanylidene-piperazin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide, SULFATE ION
著者Ostermann, N.
登録日2020-04-01
公開日2020-09-30
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.13 Å)
主引用文献Discovery of Roblitinib (FGF401) as a Reversible-Covalent Inhibitor of the Kinase Activity of Fibroblast Growth Factor Receptor 4.
J.Med.Chem., 63, 2020
7R0N
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BU of 7r0n by Molmil
KRasG12C in complex with GDP and compound 2
分子名称: GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
著者Ostermann, N.
登録日2022-02-02
公開日2022-04-27
最終更新日2022-06-15
実験手法X-RAY DIFFRACTION (1.2 Å)
主引用文献Discovery, Preclinical Characterization, and Early Clinical Activity of JDQ443, a Structurally Novel, Potent, and Selective Covalent Oral Inhibitor of KRASG12C.
Cancer Discov, 12, 2022
7R0M
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KRasG12C in complex with GDP and JDQ443
分子名称: 1-[6-[4-(5-chloranyl-6-methyl-1~{H}-indazol-4-yl)-5-methyl-3-(1-methylindazol-5-yl)pyrazol-1-yl]-2-azaspiro[3.3]heptan-2-yl]propan-1-one, GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, ...
著者Ostermann, N.
登録日2022-02-02
公開日2022-04-27
最終更新日2022-06-15
実験手法X-RAY DIFFRACTION (1.611 Å)
主引用文献Discovery, Preclinical Characterization, and Early Clinical Activity of JDQ443, a Structurally Novel, Potent, and Selective Covalent Oral Inhibitor of KRASG12C.
Cancer Discov, 12, 2022
7R0Q
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BU of 7r0q by Molmil
KRasG12C in complex with GDP and compound 3
分子名称: GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
著者Ostermann, N.
登録日2022-02-02
公開日2022-04-27
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Discovery, Preclinical Characterization, and Early Clinical Activity of JDQ443, a Structurally Novel, Potent, and Selective Covalent Oral Inhibitor of KRASG12C.
Cancer Discov, 12, 2022
5NWZ
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FIBROBLAST GROWTH FACTOR RECEPTOR 4 KINASE DOMAIN (449-753) IN COMPLEX WITH IRREVERSIBLE LIGAND CGA159527
分子名称: Fibroblast growth factor receptor 4, ~{N}-[3-[2-(3,5-dimethoxyphenyl)ethyl]-1~{H}-pyrazol-5-yl]-2-(propanoylamino)benzamide
著者Zou, C.
登録日2017-05-09
公開日2018-04-04
最終更新日2018-08-29
実験手法X-RAY DIFFRACTION (2.37 Å)
主引用文献Approaches to selective fibroblast growth factor receptor 4 inhibition through targeting the ATP-pocket middle-hinge region.
Medchemcomm, 8, 2017
5NUD
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BU of 5nud by Molmil
FIBROBLAST GROWTH FACTOR RECEPTOR 4 KINASE DOMAIN (449-753) IN COMPLEX WITH IRREVERSIBLE LIGAND CGA159527
分子名称: 3-chloranyl-~{N}-(3-nitropyridin-2-yl)-5-(trifluoromethyl)pyridin-2-amine, Fibroblast growth factor receptor 4
著者Zou, C.
登録日2017-04-29
公開日2018-04-04
最終更新日2018-08-29
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Approaches to selective fibroblast growth factor receptor 4 inhibition through targeting the ATP-pocket middle-hinge region.
Medchemcomm, 8, 2017
8AQ5
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BU of 8aq5 by Molmil
KRAS G12C IN COMPLEX WITH GDP AND COMPOUND 16
分子名称: 1-[6-[4-(5-chloranyl-6-methyl-1~{H}-indazol-4-yl)-5-methyl-3-phenyl-pyrazol-1-yl]-2-azaspiro[3.3]heptan-2-yl]propan-1-one, GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, ...
著者Ostermann, N.
登録日2022-08-11
公開日2022-12-07
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献JDQ443, a Structurally Novel, Pyrazole-Based, Covalent Inhibitor of KRAS G12C for the Treatment of Solid Tumors.
J.Med.Chem., 65, 2022
8AQ7
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BU of 8aq7 by Molmil
KRAS G12C IN COMPLEX WITH GDP AND COMPOUND 9
分子名称: 1-[6-[3-cyclohexyl-5-methyl-4-(5-methyl-1~{H}-indazol-4-yl)pyrazol-1-yl]-2-azaspiro[3.3]heptan-2-yl]propan-1-one, GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, ...
著者Ostermann, N.
登録日2022-08-11
公開日2022-12-07
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献JDQ443, a Structurally Novel, Pyrazole-Based, Covalent Inhibitor of KRAS G12C for the Treatment of Solid Tumors.
J.Med.Chem., 65, 2022
7T7T
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BU of 7t7t by Molmil
Structure of TSK/BRU1 bound to histone H3.1
分子名称: Histone H3.1, Protein TONSOKU
著者Davarinejad, H, Couture, J.F.
登録日2021-12-15
公開日2022-03-30
実験手法X-RAY DIFFRACTION (3.17 Å)
主引用文献The histone H3.1 variant regulates TONSOKU-mediated DNA repair during replication.
Science, 375, 2022
7UX9
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BU of 7ux9 by Molmil
Arabidopsis DDM1 bound to nucleosome (H2A.W, H2B, H3.3, H4, with 147 bp DNA)
分子名称: ATP-dependent DNA helicase DDM1, DNA (antisense strand), DNA (sense strand), ...
著者Ipsaro, J.J, Adams, D.W, Joshua-Tor, L.
登録日2022-05-05
公開日2023-08-09
最終更新日2023-09-27
実験手法ELECTRON MICROSCOPY (3.2 Å)
主引用文献Chromatin remodeling of histone H3 variants by DDM1 underlies epigenetic inheritance of DNA methylation.
Cell, 186, 2023
4O30
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BU of 4o30 by Molmil
Crystal structure of ATXR5 in complex with histone H3.1 and AdoHcy
分子名称: BETA-MERCAPTOETHANOL, DIMETHYL SULFOXIDE, Histone-lysine N-methyltransferase ATXR6, ...
著者Bergamin, E, Mongeon, V, Couture, J.F.
登録日2013-12-17
公開日2014-03-26
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Selective methylation of histone H3 variant H3.1 regulates heterochromatin replication.
Science, 343, 2014

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