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PDB: 376 件

7SH5
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BU of 7sh5 by Molmil
Crystal structure of CYP142A3 from Mycobacterium ulcerans bound to Cholest-4-en-3-one
分子名称: (8ALPHA,9BETA)-CHOLEST-4-EN-3-ONE, ACETATE ION, Cytochrome P450 142A3, ...
著者Doherty, D.Z, Bell, S.G, Bruning, J.
登録日2021-10-08
公開日2022-10-05
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.83 Å)
主引用文献The Structures of the Steroid Binding CYP142 Cytochrome P450 Enzymes from Mycobacterium ulcerans and Mycobacterium marinum.
Acs Infect Dis., 8, 2022
8GDI
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BU of 8gdi by Molmil
X-ray crystal structure of CYP124A1 from Mycobacterium Marinum in complex with 7-ketocholesterol
分子名称: (3beta,8alpha,9beta)-3-hydroxycholest-5-en-7-one, Cytochrome P450 124A1, PROTOPORPHYRIN IX CONTAINING FE
著者Ghith, A, Bruning, J.B, Bell, S.G.
登録日2023-03-06
公開日2023-05-24
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.81 Å)
主引用文献The oxidation of cholesterol derivatives by the CYP124 and CYP142 enzymes from Mycobacterium marinum.
J.Steroid Biochem.Mol.Biol., 231, 2023
8GLY
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BU of 8gly by Molmil
Crystal structure of T252E-CYP199A4 in complex with 4-hydroxybenzoic acid
分子名称: CHLORIDE ION, Cytochrome P450, P-HYDROXYBENZOIC ACID, ...
著者Lee, J.H.Z, Bruning, J.B, Bell, S.G.
登録日2023-03-23
公開日2024-02-07
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.03 Å)
主引用文献An In Crystallo Reaction with an Engineered Cytochrome P450 Peroxygenase.
Chemistry, 30, 2024
8GM1
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BU of 8gm1 by Molmil
Crystal structure of T252E-CYP199A4 in complex with 4-methoxybenzoic acid soaked with 1 mM hydrogen peroxide
分子名称: 4-METHOXYBENZOIC ACID, CHLORIDE ION, Cytochrome P450, ...
著者Lee, J.H.Z, Bruning, J.B, Bell, S.G.
登録日2023-03-24
公開日2024-02-07
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献An In Crystallo Reaction with an Engineered Cytochrome P450 Peroxygenase.
Chemistry, 30, 2024
8GLZ
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BU of 8glz by Molmil
Crystal structure of T252E-CYP199A4 in complex with 4-hydroxybenzoic acid. Crystal was initially co-crystallised with 4-methoxybenzoic acid and soaked with 4 mM hydrogen peroxide
分子名称: CHLORIDE ION, Cytochrome P450, P-HYDROXYBENZOIC ACID, ...
著者Lee, J.H.Z, Bruning, J.B, Bell, S.G.
登録日2023-03-23
公開日2023-12-27
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.02 Å)
主引用文献An In Crystallo Reaction with an Engineered Cytochrome P450 Peroxygenase.
Chemistry, 30, 2024
8GM2
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BU of 8gm2 by Molmil
Crystal structure of T252E-CYP199A4 in complex with 4-methoxybenzoic acid soaked with 2 mM hydrogen peroxide
分子名称: 4-METHOXYBENZOIC ACID, Cytochrome P450, PROTOPORPHYRIN IX CONTAINING FE
著者Lee, J.H.Z, Bruning, J.B, Bell, S.G.
登録日2023-03-24
公開日2023-12-27
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.33 Å)
主引用文献An In Crystallo Reaction with an Engineered Cytochrome P450 Peroxygenase.
Chemistry, 30, 2024
7N60
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BU of 7n60 by Molmil
The crystal structure of 4-methoxybenzoate-bound CYP199A S244D mutant
分子名称: 4-METHOXYBENZOIC ACID, CHLORIDE ION, Cytochrome P450, ...
著者Lau, I.C.K, Coleman, T, Bell, S.G, Bruning, J.B.
登録日2021-06-07
公開日2022-06-15
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.892 Å)
主引用文献The crystal structure of 4-methoxybenzoate-bound CYP199A S244D mutant
To Be Published
7N14
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BU of 7n14 by Molmil
Crystal structure of 4-(1H-1,2,4-triazol-1-yl)benzoic acid-bound CYP199A4
分子名称: 4-(1H-1,2,4-triazol-1-yl)benzoic acid, CHLORIDE ION, Cytochrome P450, ...
著者Podgorski, M.N, Bruning, J.B, Bell, S.G.
登録日2021-05-26
公開日2022-02-02
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.537 Å)
主引用文献To Be, or Not to Be, an Inhibitor: A Comparison of Azole Interactions with and Oxidation by a Cytochrome P450 Enzyme.
Inorg.Chem., 61, 2022
4AYB
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BU of 4ayb by Molmil
RNAP at 3.2Ang
分子名称: DNA-DIRECTED RNA POLYMERASE, IRON/SULFUR CLUSTER, MAGNESIUM ION, ...
著者Wojtas, M.N, Mogni, M, Millet, O, Bell, S.D, Abrescia, N.G.A.
登録日2012-06-19
公開日2012-08-08
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (3.202 Å)
主引用文献Structural and Functional Analyses of the Interaction of Archaeal RNA Polymerase with DNA.
Nucleic Acids Res., 40, 2012
5KT1
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BU of 5kt1 by Molmil
The crystal structure of 4-methylthiobenzoate-bound CYP199A4
分子名称: 4-methylsulfanylbenzoic acid, CHLORIDE ION, Cytochrome P450, ...
著者Coleman, T, Bruning, J.B, Bell, S.G.
登録日2016-07-11
公開日2018-01-17
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.015 Å)
主引用文献The crystal structure of 4-methylthiobenzoate-bound CYP199A4
To Be Published
8FKB
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BU of 8fkb by Molmil
X-ray crystal structure of CYP124A1 from Mycobacterium Marinum bound to Farnesol
分子名称: (2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol, Cytochrome P450 124A1, DI(HYDROXYETHYL)ETHER, ...
著者Ghith, A, Bruning, J.B, Bell, S.G.
登録日2022-12-21
公開日2023-03-29
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.42 Å)
主引用文献The catalytic activity and structure of the lipid metabolizing CYP124 cytochrome P450 enzyme from Mycobacterium marinum.
Arch.Biochem.Biophys., 737, 2023
8FLO
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BU of 8flo by Molmil
X-ray crystal structure of substrate free CYP124A1 from Mycobacterium Marinum
分子名称: Cytochrome P450 124A1, DI(HYDROXYETHYL)ETHER, GLYCEROL, ...
著者Ghith, A, Bruning, J.B, Bell, S.G.
登録日2022-12-22
公開日2023-03-29
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.71 Å)
主引用文献The catalytic activity and structure of the lipid metabolizing CYP124 cytochrome P450 enzyme from Mycobacterium marinum.
Arch.Biochem.Biophys., 737, 2023
8FJO
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BU of 8fjo by Molmil
X-ray crystal structure of CYP124A1 from Mycobacterium Marinum in complex with farnesyl acetate
分子名称: (2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl acetate, AMMONIUM ION, Cytochrome P450 124A1, ...
著者Ghith, A, Bruning, J.B, Bell, S.G.
登録日2022-12-20
公開日2023-03-29
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.69 Å)
主引用文献The catalytic activity and structure of the lipid metabolizing CYP124 cytochrome P450 enzyme from Mycobacterium marinum.
Arch.Biochem.Biophys., 737, 2023
6WZP
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BU of 6wzp by Molmil
The crystal structure of 4-vinylbenzoate-bound T252A mutant CYP199A4
分子名称: 4-ethenylbenzoic acid, CHLORIDE ION, Cytochrome P450, ...
著者Coleman, T, Bruning, J.B, Bell, S.G.
登録日2020-05-14
公開日2021-05-19
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Understanding the Mechanistic Requirements for Efficient and Stereoselective Alkene Epoxidation by a Cytochrome P450 Enzyme
Acs Catalysis, 11, 2021
7TLO
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BU of 7tlo by Molmil
X-ray crystal structure of substrate free cytochrome P450 CYP142A3 from Mycobacterium Marinum
分子名称: ACETATE ION, Cytochrome P450 142A3, PROTOPORPHYRIN IX CONTAINING FE
著者Ghith, A, Bruning, J.B, Bell, S.G.
登録日2022-01-18
公開日2022-09-14
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献The Structures of the Steroid Binding CYP142 Cytochrome P450 Enzymes from Mycobacterium ulcerans and Mycobacterium marinum.
Acs Infect Dis., 8, 2022
7TND
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BU of 7tnd by Molmil
The crystal structure of CYP199A4 bound to 4-phenoxybenzoic acid
分子名称: 4-phenoxybenzoic acid, CHLORIDE ION, Cytochrome P450, ...
著者Podgorski, M, Bell, S.G.
登録日2022-01-20
公開日2023-01-04
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.825 Å)
主引用文献Enabling Aromatic Hydroxylation in a Cytochrome P450 Monooxygenase Enzyme through Protein Engineering.
Chemistry, 28, 2022
7TNF
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BU of 7tnf by Molmil
The crystal structure of F298V CYP199A4 bound to 4-phenylbenzoic acid
分子名称: CHLORIDE ION, Cytochrome P450, MAGNESIUM ION, ...
著者Podgorski, M, Bell, S.G.
登録日2022-01-21
公開日2023-01-04
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.539 Å)
主引用文献Enabling Aromatic Hydroxylation in a Cytochrome P450 Monooxygenase Enzyme through Protein Engineering.
Chemistry, 28, 2022
7TNU
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BU of 7tnu by Molmil
The crystal structure of F298V CYP199A4 bound to 4-cyclohexylbenzoic acid
分子名称: 4-cyclohexylbenzoic acid, CHLORIDE ION, Cytochrome P450, ...
著者Podgorski, M, Bell, S.G.
登録日2022-01-21
公開日2023-01-04
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.584 Å)
主引用文献Enabling Aromatic Hydroxylation in a Cytochrome P450 Monooxygenase Enzyme through Protein Engineering.
Chemistry, 28, 2022
7TZM
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BU of 7tzm by Molmil
The crystal structure of WT CYP199A4 bound to 4-iodobenzoic acid
分子名称: 4-iodobenzoic acid, CHLORIDE ION, Cytochrome P450, ...
著者Podgorski, M.N, Bell, S.G.
登録日2022-02-16
公開日2023-03-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.524 Å)
主引用文献Cytochrome P450-catalyzed oxidation of halogen-containing substrates.
J.Inorg.Biochem., 244, 2023
7TZY
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BU of 7tzy by Molmil
The crystal structure of WT CYP199A4 bound to 4-(2-bromoethyl)benzoic acid
分子名称: 4-(2-bromoethyl)benzoic acid, CHLORIDE ION, Cytochrome P450, ...
著者Podgorski, M.N, Bell, S.G.
登録日2022-02-16
公開日2023-03-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.992 Å)
主引用文献Cytochrome P450-catalyzed oxidation of halogen-containing substrates.
J.Inorg.Biochem., 244, 2023
7U00
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BU of 7u00 by Molmil
The crystal structure of WT CYP199A4 bound to 4-(2-chloroethyl)benzoic acid
分子名称: 4-(2-chloroethyl)benzoic acid, CHLORIDE ION, Cytochrome P450, ...
著者Podgorski, M.N, Bell, S.G.
登録日2022-02-17
公開日2023-03-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.657 Å)
主引用文献Cytochrome P450-catalyzed oxidation of halogen-containing substrates.
J.Inorg.Biochem., 244, 2023
7TZN
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BU of 7tzn by Molmil
The crystal structure of WT CYP199A4 bound to 4-fluorobenzoic acid
分子名称: 4-fluorobenzoic acid, CHLORIDE ION, Cytochrome P450, ...
著者Podgorski, M.N, Bell, S.G.
登録日2022-02-16
公開日2023-03-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.839 Å)
主引用文献Cytochrome P450-catalyzed oxidation of halogen-containing substrates.
J.Inorg.Biochem., 244, 2023
7TRT
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BU of 7trt by Molmil
The crystal structure of CYP199A4 bound to 4-(furan-2-yl)benzoic acid
分子名称: 4-(furan-2-yl)benzoic acid, CHLORIDE ION, Cytochrome P450, ...
著者Podgorski, M.N, Bell, S.G.
登録日2022-01-30
公開日2023-03-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.42 Å)
主引用文献The Oxidation of Oxygen and Sulfur-Containing Heterocycles by Cytochrome P450 Enzymes.
Chemistry, 29, 2023
7TZW
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BU of 7tzw by Molmil
The crystal structure of WT CYP199A4 bound to 4-chlorobenzoic acid
分子名称: 4-CHLORO-BENZOIC ACID, CHLORIDE ION, Cytochrome P450, ...
著者Podgorski, M.N, Bell, S.G.
登録日2022-02-16
公開日2023-03-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.462 Å)
主引用文献Cytochrome P450-catalyzed oxidation of halogen-containing substrates.
J.Inorg.Biochem., 244, 2023
7TZX
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BU of 7tzx by Molmil
The crystal structure of WT CYP199A4 bound to 4-chloromethylbenzoic acid
分子名称: 4-(chloromethyl)benzoic acid, CHLORIDE ION, Cytochrome P450, ...
著者Podgorski, M.N, Scaffidi-Muta, J, Bell, S.G.
登録日2022-02-16
公開日2023-03-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.414 Å)
主引用文献Cytochrome P450-catalyzed oxidation of halogen-containing substrates.
J.Inorg.Biochem., 244, 2023

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件を2024-11-13に公開中

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