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5JWA
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BU of 5jwa by Molmil
the structure of malaria PfNDH2
分子名称: ACETATE ION, FLAVIN-ADENINE DINUCLEOTIDE, FRAGMENT OF TRITON X-100, ...
著者Yu, Y, Yang, Y.Q, Li, X.L, Yu, J, Ge, J.P, Li, J, Rao, Y, Yang, M.J.
登録日2016-05-11
公開日2017-03-22
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.162 Å)
主引用文献Target Elucidation by Cocrystal Structures of NADH-Ubiquinone Oxidoreductase of Plasmodium falciparum (PfNDH2) with Small Molecule To Eliminate Drug-Resistant Malaria
J. Med. Chem., 60, 2017
3I63
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BU of 3i63 by Molmil
Peroxide Bound Toluene 4-Monooxygenase
分子名称: FE (III) ION, HYDROGEN PEROXIDE, Toluene-4-monooxygenase system protein A, ...
著者Bailey, L.J, Fox, B.G.
登録日2009-07-06
公開日2009-10-13
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.09 Å)
主引用文献Crystallographic and catalytic studies of the peroxide-shunt reaction in a diiron hydroxylase.
Biochemistry, 48, 2009
9IWV
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BU of 9iwv by Molmil
Crystal structure of Lsd18 after incubation with the substrate
分子名称: CHLORIDE ION, FLAVIN-ADENINE DINUCLEOTIDE, GLYCEROL, ...
著者Wang, Q, Kim, C.Y, Chen, X.
登録日2024-07-26
公開日2025-04-16
最終更新日2025-05-21
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Mechanistic and molecular insights into iterative triepoxidation catalyzed by monooxygenase MonCI using a natural substrate analog.
Int.J.Biol.Macromol., 311, 2025
1APC
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BU of 1apc by Molmil
SOLUTION STRUCTURE OF APOCYTOCHROME B562
分子名称: CYTOCHROME B562
著者Wand, A.J, Feng, Y, Sligar, S.G.
登録日1993-10-14
公開日1994-01-31
最終更新日2024-04-10
実験手法SOLUTION NMR
主引用文献Solution structure of apocytochrome b562.
Nat.Struct.Biol., 1, 1994
8YOQ
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BU of 8yoq by Molmil
Crystal structure of hFSP1 with both 6-OH-FAD and NADP (hFSP1-6-OH-FAD-NADP)
分子名称: 6-HYDROXY-FLAVIN-ADENINE DINUCLEOTIDE, Ferroptosis suppressor protein 1, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
著者Lan, H.Y, Gao, Y, Hong, T, Zhao, Z.Z, Chang, Z.H, Wang, Y.F, Wang, F.
登録日2024-03-13
公開日2025-01-08
実験手法X-RAY DIFFRACTION (1.79 Å)
主引用文献Structural insight into 6-OH-FAD-dependent activation of hFSP1 for ferroptosis suppression.
Cell Discov, 10, 2024
8YO8
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BU of 8yo8 by Molmil
Crystal structure of hFSP1 with both 6-OH-FAD and NAD (hFSP1-6-OH-FAD-NAD)
分子名称: 6-HYDROXY-FLAVIN-ADENINE DINUCLEOTIDE, Ferroptosis suppressor protein 1, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ...
著者Lan, H.Y, Gao, Y, Hong, T, Zhao, Z.Z, Chang, Z.H, Wang, Y.F, Wang, F.
登録日2024-03-12
公開日2025-01-08
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structural insight into 6-OH-FAD-dependent activation of hFSP1 for ferroptosis suppression.
Cell Discov, 10, 2024
8YOX
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BU of 8yox by Molmil
Crystal structure of hFSP1 with 6-OH-FAD (hFSP1-6-OH-FAD)
分子名称: 6-HYDROXY-FLAVIN-ADENINE DINUCLEOTIDE, Ferroptosis suppressor protein 1, SULFATE ION
著者Lan, H.Y, Gao, Y, Hong, T, Zhao, Z.Z, Chang, Z.H, Wang, Y.F, Wang, F.
登録日2024-03-14
公開日2025-01-08
実験手法X-RAY DIFFRACTION (2.48 Å)
主引用文献Structural insight into 6-OH-FAD-dependent activation of hFSP1 for ferroptosis suppression.
Cell Discov, 10, 2024
1NDL
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BU of 1ndl by Molmil
THE AWD NUCLEOTIDE DIPHOSPHATE KINASE FROM DROSOPHILA
分子名称: NUCLEOSIDE DIPHOSPHATE KINASE
著者Janin, J, Chiadmi, M, Dumas, C, Lascu, I, Lebras, G, Morera, S, Veron, M.
登録日1993-11-27
公開日1994-04-30
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Crystal structure of the Awd nucleotide diphosphate kinase from Drosophila.
Structure, 1, 1993
9CVU
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BU of 9cvu by Molmil
Structure of human neuronal nitric oxide synthase R354A/G357D mutant heme domain bound with 4-methyl-6-(3-((methylamino)methyl)-5-(trifluoromethyl)phenyl)pyridin-2-amine dihydrochloride
分子名称: (6P)-4-methyl-6-{3-[(methylamino)methyl]-5-(trifluoromethyl)phenyl}pyridin-2-amine, 5,6,7,8-TETRAHYDROBIOPTERIN, GLYCEROL, ...
著者Li, H, Poulos, T.L.
登録日2024-07-29
公開日2025-04-30
実験手法X-RAY DIFFRACTION (1.94 Å)
主引用文献Truncated pyridinylbenzylamines: Potent, selective, and highly membrane permeable inhibitors of human neuronal nitric oxide synthase.
Bioorg.Med.Chem., 124, 2025
9CW1
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BU of 9cw1 by Molmil
Structure of human neuronal nitric oxide synthase R354A/G357D mutant heme domain bound with 6-(2,3-difluoro-5-(2-(methylamino)ethyl)phenyl)-4-methylpyridin-2-amine dihydrochloride
分子名称: (6M)-6-{2,3-difluoro-5-[2-(methylamino)ethyl]phenyl}-4-methylpyridin-2-amine, 5,6,7,8-TETRAHYDROBIOPTERIN, GLYCEROL, ...
著者Li, H, Poulos, T.L.
登録日2024-07-29
公開日2025-04-30
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Truncated pyridinylbenzylamines: Potent, selective, and highly membrane permeable inhibitors of human neuronal nitric oxide synthase.
Bioorg.Med.Chem., 124, 2025
1MMM
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BU of 1mmm by Molmil
DISTINCT METAL ENVIRONMENT IN IRON-SUBSTITUTED MANGANESE SUPEROXIDE DISMUTASE PROVIDES A STRUCTURAL BASIS OF METAL SPECIFICITY
分子名称: FE (III) ION, HYDROXIDE ION, PROTEIN (IRON-SUBSTITUTED MANGANESE SUPEROXIDE DISMUTASE)
著者Edwards, R.A, Whittaker, M.M, Whittaker, J.W, Jameson, G.B, Baker, E.N.
登録日1998-08-26
公開日1998-09-02
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Distinct Metal Environment in Fe-Substituted Manganese Superoxide Dismutase Provides a Structural Basis of Metal Specificity
J.Am.Chem.Soc., 120, 1998
5WP2
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BU of 5wp2 by Molmil
1.44 Angstrom crystal structure of CYP121 from Mycobacterium tuberculosis in complex with substrate and CN
分子名称: (3S,6S)-3,6-bis(4-hydroxybenzyl)piperazine-2,5-dione, CYANIDE ION, Mycocyclosin synthase, ...
著者Fielding, A, Dornevil, K, Liu, A.
登録日2017-08-03
公開日2018-05-30
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (1.439 Å)
主引用文献Probing Ligand Exchange in the P450 Enzyme CYP121 from Mycobacterium tuberculosis: Dynamic Equilibrium of the Distal Heme Ligand as a Function of pH and Temperature.
J. Am. Chem. Soc., 139, 2017
6QO0
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BU of 6qo0 by Molmil
I47W mutated sulfur oxygenase reductase from Acidianus ambivaens
分子名称: FE (III) ION, Sulfur oxygenase/reductase
著者Frazao, C, Klezin, A, Poell, U.
登録日2019-02-12
公開日2020-03-04
最終更新日2024-05-15
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Multiple sulfane modifications in active-site cysteine thiols of two sulfur oxygenase reductases and analysis of substrate/product channels
To Be Published
1SSO
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BU of 1sso by Molmil
SOLUTION STRUCTURE AND DNA-BINDING PROPERTIES OF A THERMOSTABLE PROTEIN FROM THE ARCHAEON SULFOLOBUS SOLFATARICUS
分子名称: SSO7D
著者Baumann, H, Knapp, S, Lundback, T, Ladenstein, R, Hard, T.
登録日1995-03-31
公開日1995-05-08
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Solution structure and DNA-binding properties of a thermostable protein from the archaeon Sulfolobus solfataricus.
Nat.Struct.Biol., 1, 1994
6ICP
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BU of 6icp by Molmil
Pseudomonas putida CBB5 NdmA QL mutant with caffeine
分子名称: CAFFEINE, FE (III) ION, FE2/S2 (INORGANIC) CLUSTER, ...
著者Kim, J.H, Kim, B.H, Kang, S.Y, Song, H.K.
登録日2018-09-06
公開日2019-09-04
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structural and Mechanistic Insights into Caffeine Degradation by the Bacterial N-Demethylase Complex.
J.Mol.Biol., 431, 2019
1CCN
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BU of 1ccn by Molmil
DIRECT NOE REFINEMENT OF CRAMBIN FROM 2D NMR DATA USING A SLOW-COOLING ANNEALING PROTOCOL
分子名称: CRAMBIN
著者Bonvin, A.M.J.J, Rullmann, J.A.C, Lamerichs, R.M.J.N, Boelens, R, Kaptein, R.
登録日1993-04-14
公開日1993-10-31
最終更新日2024-11-06
実験手法SOLUTION NMR
主引用文献Direct NOE refinement of biomolecular structures using 2D NMR data
J.Biomol.NMR, 1, 1991
5LY1
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BU of 5ly1 by Molmil
JMJD2A/ KDM4A COMPLEXED WITH NI(II) AND Macrocyclic PEPTIDE Inhibitor CP2 (13-mer)
分子名称: CHLORIDE ION, CP2, GLYCEROL, ...
著者King, O.N.F, Chowdhury, R, Kawamura, A, Schofield, C.J.
登録日2016-09-23
公開日2017-04-12
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Highly selective inhibition of histone demethylases by de novo macrocyclic peptides.
Nat Commun, 8, 2017
6ICN
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BU of 6icn by Molmil
Pseudomonas putida CBB5 NdmA with caffeine
分子名称: CAFFEINE, COBALT (II) ION, FE2/S2 (INORGANIC) CLUSTER, ...
著者Kim, J.H, Kim, B.H, Kang, S.Y, Song, H.K.
登録日2018-09-06
公開日2019-09-04
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Structural and Mechanistic Insights into Caffeine Degradation by the Bacterial N-Demethylase Complex.
J.Mol.Biol., 431, 2019
7KPZ
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BU of 7kpz by Molmil
1.70 A resolution crystal structure of Group A Streptococcus HupZ-V5-His6
分子名称: HupZ
著者Li, J, Liu, A.
登録日2020-11-13
公開日2021-02-10
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.703 Å)
主引用文献Heme Binding to HupZ with a C-Terminal Tag from Group A Streptococcus.
Molecules, 26, 2021
7E0C
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BU of 7e0c by Molmil
Structure of L-glutamate oxidase R305E mutant
分子名称: FLAVIN-ADENINE DINUCLEOTIDE, L-glutamate oxidase
著者Ito, N, Matsuo, S, Inagaki, K, Imada, K.
登録日2021-01-27
公開日2021-04-07
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.65 Å)
主引用文献A new l-arginine oxidase engineered from l-glutamate oxidase.
Protein Sci., 30, 2021
7E0D
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BU of 7e0d by Molmil
Structure of L-glutamate oxidase R305E mutant in complex with L-arginine
分子名称: ARGININE, FLAVIN-ADENINE DINUCLEOTIDE, L-glutamate oxidase
著者Ito, N, Matsuo, S, Inagaki, K, Imada, K.
登録日2021-01-27
公開日2021-04-07
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献A new l-arginine oxidase engineered from l-glutamate oxidase.
Protein Sci., 30, 2021
5IBO
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BU of 5ibo by Molmil
1.95A resolution structure of NanoLuc luciferase
分子名称: DECANOIC ACID, Oplophorus-luciferin 2-monooxygenase catalytic subunit
著者Lovell, S, Mehzabeen, N, Battaile, K.P, Wood, M.G, Encell, L.P, Wood, K.V.
登録日2016-02-22
公開日2016-04-13
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献To be determined
To be published
5ZMD
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BU of 5zmd by Molmil
Crystal structure of FTO in complex with m6dA modified ssDNA
分子名称: Alpha-ketoglutarate-dependent dioxygenase FTO, DNA (5'-D(P*TP*CP*TP*(6MA)P*TP*AP*TP*CP*G)-3'), MANGANESE (II) ION, ...
著者Zhang, X, Wei, L.H, Luo, J, Xiao, Y, Liu, J, Zhang, W, Zhang, L, Jia, G.F.
登録日2018-04-02
公開日2019-04-10
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (3.3 Å)
主引用文献Structural insights into FTO's catalytic mechanism for the demethylation of multiple RNA substrates.
Proc. Natl. Acad. Sci. U.S.A., 116, 2019
1BFY
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BU of 1bfy by Molmil
SOLUTION STRUCTURE OF REDUCED CLOSTRIDIUM PASTEURIANUM RUBREDOXIN, NMR, 20 STRUCTURES
分子名称: FE (III) ION, RUBREDOXIN
著者Bertini, I, Kurtz Junior, D.M, Eidsness, M.K, Liu, G, Luchinat, C, Rosato, A, Scott, R.A.
登録日1998-05-23
公開日1999-05-25
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Solution Structure of Reduced Clostridium Pasteurianum Rubredoxin
J.Biol.Inorg.Chem., 3, 1998
5JSK
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BU of 5jsk by Molmil
The 3D structure of [NiFeSe] hydrogenase from Desulfovibrio vulgaris Hildenborough in the reduced state at 0.95 Angstrom resolution
分子名称: CARBONMONOXIDE-(DICYANO) IRON, FE (II) ION, GLYCEROL, ...
著者Marques, M.C, Pereira, I.A.C, Matias, P.M.
登録日2016-05-08
公開日2017-03-22
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (0.95 Å)
主引用文献The direct role of selenocysteine in [NiFeSe] hydrogenase maturation and catalysis.
Nat. Chem. Biol., 13, 2017

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