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PDB: 119 件
7ZNM
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Artificial Unspecific Peroxygenase expressed in Pichia pastoris at 2.01 Angstrom resolution
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Artificial Unspecific Peroxygenase, ...
著者Robinson, W.X.Q, Mielke, T, Grogan, G.
登録日2022-04-21
公開日2023-03-01
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.01 Å)
主引用文献Comparing the Catalytic and Structural Characteristics of a 'Short' Unspecific Peroxygenase (UPO) Expressed in Pichia pastoris and Escherichia coli.
Chembiochem, 24, 2023
7ZNV
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Artificial Unspecific Peroxygenase expressed in Pichia pastoris at 1.21 Angstrom resolution
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, MAGNESIUM ION, ...
著者Robinson, W.X.Q, Mielke, T, Grogan, G.
登録日2022-04-22
公開日2023-03-01
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.21 Å)
主引用文献Comparing the Catalytic and Structural Characteristics of a 'Short' Unspecific Peroxygenase (UPO) Expressed in Pichia pastoris and Escherichia coli.
Chembiochem, 24, 2023
8AV5
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Glycosylated PaDa-I mutant of Unspecific Peroxygenase from Agrocybe aegerita
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ACETATE ION, ...
著者Mielke, T.F, Grogan, G.
登録日2022-08-26
公開日2023-08-02
実験手法X-RAY DIFFRACTION (1.62 Å)
主引用文献Glycosylated PaDa-I mutant of Unspecific Peroxygenase from Agrocybe aegerita
To Be Published
8A3X
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Imine Reductase from Ensifer adhaerens in complex with NADP+
分子名称: NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, NAD_binding_2 domain-containing protein, POTASSIUM ION
著者Gilio, A.K, Grogan, G.
登録日2022-06-09
公開日2023-03-08
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.58 Å)
主引用文献A Reductive Aminase Switches to Imine Reductase Mode for a Bulky Amine Substrate.
Acs Catalysis, 13, 2023
8A5Z
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Imine Reductase from Ensifer adhaerens A208N mutant in complex with NADP+
分子名称: IODIDE ION, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, NAD_binding_2 domain-containing protein
著者Gilio, A.K, Grogan, G.
登録日2022-06-16
公開日2023-03-08
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.31 Å)
主引用文献A Reductive Aminase Switches to Imine Reductase Mode for a Bulky Amine Substrate.
Acs Catalysis, 13, 2023
8BJ5
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Imine Reductase IR007 from Amycolatopsis azurea
分子名称: Imine Reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
著者Gilio, A.K, Steflik, J, Grogan, G.
登録日2022-11-03
公開日2023-09-20
実験手法X-RAY DIFFRACTION (2.72 Å)
主引用文献Engineering of a Reductive Aminase to Enable the Synthesis of a Key Intermediate to a CDK 2/4/6 Inhibitor
Acs Catalysis, 13, 2023
6IAU
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Amine Dehydrogenase from Cystobacter fuscus in complex with NADP+ and cyclohexylamine
分子名称: Amine Dehydrogenase, CYCLOHEXYLAMMONIUM ION, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
著者Beloti, L, Mayol, O, Turkenburg, J.P, Vaxelaire-Vergne, C, Grogan, G.
登録日2018-11-27
公開日2019-03-27
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.97 Å)
主引用文献A family of native amine dehydrogenases for the asymmetric reductive amination of ketones
Nat Catal, 2019
6H7P
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Reductive Aminase from Aspergillus terreus in complex with NADPH4, cyclohexanone and allyl amine
分子名称: CYCLOHEXANONE, Reductive Aminase, [[(2~{R},3~{S},4~{R},5~{R})-5-[(3~{R})-3-aminocarbonylpiperidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2~{R},3~{R},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3-oxidanyl-4-phosphonooxy-oxolan-2-yl]methyl hydrogen phosphate, ...
著者Sharma, M, Grogan, G, Mangas-Sanchez, J, Turner, N.J.
登録日2018-07-31
公開日2019-04-03
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.79 Å)
主引用文献Structure of Reductive Aminase from Aspergillus terreus
Acs Catalysis, 2018
7A3W
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Structure of Imine Reductase from Pseudomonas sp.
分子名称: 1,2-ETHANEDIOL, GLYCEROL, NAD(P)-dependent oxidoreductase, ...
著者Cuetos, A, Thorpe, T, Turner, N.J, Grogan, G.
登録日2020-08-18
公開日2021-08-25
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.59 Å)
主引用文献Multifunctional biocatalyst for conjugate reduction and reductive amination.
Nature, 604, 2022
7AD2
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Linalool Dehydratase Isomerase G107T mutant
分子名称: Linalool dehydratase/isomerase, MALONATE ION
著者Cuetos, A, Fischer, M.P, Hauer, B, Grogan, G.
登録日2020-09-14
公開日2021-10-06
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.83 Å)
主引用文献Linalool Dehydratase Isomerase G107T mutant
To Be Published
7ANT
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Structure of CYP153A from Polaromonas sp.
分子名称: 1,2-ETHANEDIOL, Cytochrome P450, HEME C
著者Zukic, E, Rowlinson, B, Sharma, M, Hoffman, S, Hauer, B, Grogan, G.
登録日2020-10-12
公開日2021-04-07
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.52 Å)
主引用文献Substrate Anchoring and Flexibility Reduction in CYP153AM.aq Leads to Highly Improved Efficiency toward Octanoic Acid
Acs Catalysis, 11, 2021
7AO7
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Structure of CYP153A from Polaromonas sp. in complex with octan-1-ol
分子名称: Cytochrome P450, OCTAN-1-OL, PROTOPORPHYRIN IX CONTAINING FE
著者Zukic, E, Rowlinson, B, Sharma, M, Hoffmann, S, Hauer, B, Grogan, G.
登録日2020-10-13
公開日2021-04-07
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.55 Å)
主引用文献Substrate Anchoring and Flexibility Reduction in CYP153AM.aq Leads to Highly Improved Efficiency toward Octanoic Acid
Acs Catalysis, 11, 2021
3ZGJ
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BU of 3zgj by Molmil
S221M V223F Y359A mutant of 4-Hydroxymandelate synthase from Streptomyces coelicolor
分子名称: (R)-MANDELIC ACID, 4-HYDROXYPHENYLPYRUVIC ACID DIOXYGENASE, COBALT (II) ION
著者Pratter, S, Straganz, G, Grogan, G.
登録日2012-12-18
公開日2013-10-30
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Inversion of Enantioselectivity of a Mononuclear Non-Heme Iron(II)-Dependent Hydroxylase by Tuning the Interplay of Metal Center Geometry and Protein Structure
Angew.Chem.Int.Ed.Engl., 52, 2013
2J5S
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Structural of ABDH, a beta-diketone hydrolase from the Cyanobacterium Anabaena sp. PCC 7120 bound to (S)-3-oxocyclohexyl acetic acid
分子名称: (S)-CYCLOHEXANONE-2-ACETATE, BETA-DIKETONE HYDROLASE, NICKEL (II) ION
著者Bennett, J.P, Whittingham, J.L, Brzozowski, A.M, Leonard, P.M, Grogan, G.
登録日2006-09-19
公開日2007-01-08
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.57 Å)
主引用文献Structural Characterisation of a Beta Diketone Hydrolase from the Cyanobacterium Anabaena Sp. Pcc 7120 in Native and Product Bound Forms, a Coenzyme A-Independent Member of the Crotonase Suprafamily
Biochemistry, 46, 2007
2J5I
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Crystal Structure of Hydroxycinnamoyl-CoA Hydratase-Lyase
分子名称: P-HYDROXYCINNAMOYL COA HYDRATASE/LYASE
著者Leonard, P.M, Brzozowski, A.M, Lebedev, A, Marshall, C.M, Smith, D.J, Verma, C.S, Walton, N.J, Grogan, G.
登録日2006-09-18
公開日2006-12-06
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献The 1.8 A Resolution Structure of Hydroxycinnamoyl- Coenzyme a Hydratase-Lyase (Hchl) from Pseudomonas Fluorescens, an Enzyme that Catalyses the Transformation of Feruloyl-Coenzyme a to Vanillin.
Acta Crystallogr.,Sect.D, 62, 2006
2J5G
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The Native structure of a beta-Diketone Hydrolase from the Cyanobacterium Anabaena sp. PCC 7120
分子名称: ALR4455 PROTEIN, SULFATE ION
著者Bennett, J.P, Whittingham, J.L, Brzozowski, A.M, Leonard, P.M, Grogan, G.
登録日2006-09-18
公開日2007-01-16
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.46 Å)
主引用文献Structural Characterisation of a Beta Diketone Hydrolase from the Cyanobacterium Anabaena Sp. Pcc 7120 in Native and Product Bound Forms, a Coenzyme A-Independent Member of the Crotonase Suprafamily
Biochemistry, 46, 2007
2WIV
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Cytochrome-P450 XplA heme domain P21
分子名称: CYTOCHROME P450-LIKE PROTEIN XPLA, PROTOPORPHYRIN IX CONTAINING FE
著者Sabbadin, F, Jackson, R, Bruce, N.C, Grogan, G.
登録日2009-05-18
公開日2009-08-18
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献The 1.5-A Structure of Xpla-Heme, an Unusual Cytochrome P450 Heme Domain that Catalyzes Reductive Biotransformation of Royal Demolition Explosive.
J.Biol.Chem., 284, 2009
2XAA
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Alcohol dehydrogenase ADH-'A' from Rhodococcus ruber DSM 44541 at pH 8.5 in complex with NAD and butane-1,4-diol
分子名称: 1,4-BUTANEDIOL, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, SECONDARY ALCOHOL DEHYDROGENASE, ...
著者Kroutil, W, Gruber, K, Grogan, G.
登録日2010-03-30
公開日2010-08-11
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Structural Insights Into Substrate Specificity and Solvent Tolerance in Alcohol Dehydrogenase Adh-'A' from Rhodococcus Ruber Dsm 44541.
Chem.Commun.(Camb.), 46, 2010
2WIY
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Cytochrome P450 XplA heme domain P21212
分子名称: 1,2-ETHANEDIOL, CYTOCHROME P450-LIKE PROTEIN XPLA, IMIDAZOLE, ...
著者Sabbadin, F, Jackson, R, Bruce, N.C, Grogan, G.
登録日2009-05-18
公開日2009-08-18
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.49 Å)
主引用文献The 1.5-A Structure of Xpla-Heme, an Unusual Cytochrome P450 Heme Domain that Catalyzes Reductive Biotransformation of Royal Demolition Explosive.
J.Biol.Chem., 284, 2009
5A9T
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Imine Reductase from Amycolatopsis orientalis in complex with (R)- Methyltetrahydroisoquinoline
分子名称: (1R)-1-methyl-1,2,3,4-tetrahydroisoquinoline, ACETATE ION, CALCIUM ION, ...
著者Man, H, Aleku, G, Turner, N.J, Grogan, G.
登録日2015-07-22
公開日2016-06-01
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Stereoselectivity and Structural Characterization of an Imine Reductase (Ired) from Amycolatopsis Orientalis
Acs Catalysis, 6, 2016
5A9R
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Apo form of Imine reductase from Amycolatopsis orientalis
分子名称: ACETATE ION, IMINE REDUCTASE
著者Man, H, Aleku, G, Turner, N.J, Grogan, G.
登録日2015-07-22
公開日2016-06-01
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Stereoselectivity and Structural Characterization of an Imine Reductase (Ired) from Amycolatopsis Orientalis
Acs Catalysis, 6, 2016
5A9S
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NADPH complex of Imine Reductase from Amycolatopsis orientalis
分子名称: CALCIUM ION, IMINE REDUCTASE, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
著者Man, H, Aleku, G, Turner, N.J, Grogan, G.
登録日2015-07-22
公開日2016-06-01
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.06 Å)
主引用文献Stereoselectivity and Structural Characterization of an Imine Reductase (IRED) from Amycolatopsis orientalis
Acs Catalysis, 6, 2016
5FJU
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N-acyl amino acid racemase from Amycolatopsis sp. Ts-1-60: Q26A M50I G291D F323Y mutant in complex with N-acetyl phenylalanine
分子名称: MAGNESIUM ION, N-acetyl-L-phenylalanine, O-SUCCINYLBENZOATE SYNTHASE
著者Sanchez Carron, G, Campopiano, D, Grogan, G.
登録日2015-10-13
公開日2016-11-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.52 Å)
主引用文献Structure of N-Acylamino Acid Racemase Mutants in Complex with Substrates
To be Published
5FJR
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N-acyl amino acid racemase from Amycolatopsis sp. Ts-1-60: Q26A M50I G291D F323Y mutant in complex with N-acetyl napthylalanine
分子名称: MAGNESIUM ION, N-acetyl naphthylalanine, O-SUCCINYLBENZOATE SYNTHASE
著者Sanchez Carron, G, Campopiano, D, Grogan, G.
登録日2015-10-12
公開日2016-11-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.44 Å)
主引用文献Structure of N-Acylamino Acid Racemase Mutants in Complex with Substrates
To be Published
5FJP
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N-acyl amino acid racemase from Amycolatopsis sp Ts-1-60: G291D F323Y I293G mutant in complex with N-acetyl naphthylalanine
分子名称: MAGNESIUM ION, N-acetyl naphthylalanine, O-SUCCINYLBENZOATE SYNTHASE
著者Sanchez Carron, G, Campopiano, D, Grogan, G.
登録日2015-10-12
公開日2016-11-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.58 Å)
主引用文献Structure of N-Acylamino Acid Racemase Mutants in Complex with Substrates
To be Published

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