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1O8U
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THE 2 ANGSTROM STRUCTURE OF 6-OXO CAMPHOR HYDROLASE: NEW STRUCTURAL DIVERSITY IN THE CROTONASE SUPERFAMILY
Descriptor:6-OXO CAMPHOR HYDROLASE, SODIUM ION
Authors:Grogan, G., Whittingham, J.L., Turkenburg, J.P., Verma, C.S., Walsh, M.A.
Deposit date:2002-12-04
Release date:2003-01-24
Last modified:2019-01-30
Method:X-RAY DIFFRACTION (2 Å)
Cite:The 2 a Crystal Structure of 6-Oxo Camphor Hydrolase: New Structural Diversity in the Crotonase Superfamily
J.Biol.Chem., 278, 2003
6GMF
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STRUCTURE OF CYTOCHROME P450 CYP109Q5 FROM CHONDROMYCES APICULATUS
Descriptor:Putative cytochrome P450 hydroxylase, PROTOPORPHYRIN IX CONTAINING FE
Authors:Grogan, G., Dubiel, P., Sharma, M., Klenk, J., Hauer, B.
Deposit date:2018-05-25
Release date:2019-03-27
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Characterization and structure-guided engineering of the novel versatile terpene monooxygenase CYP109Q5 from Chondromyces apiculatus DSM436.
Microb Biotechnol, 12, 2019
6IAQ
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STRUCTURE OF AMINE DEHYDROGENASE FROM MYCOBACTERIUM SMEGMATIS
Descriptor:Dihydrodipicolinate reductase N-terminus domain-containing protein, 1,2-ETHANEDIOL, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Grogan, G., Vaxelaire-Vergne, C., Beloti, L., Mayol, O.
Deposit date:2018-11-27
Release date:2019-03-27
Method:X-RAY DIFFRACTION (1.91 Å)
Cite:A family of native amine dehydrogenases for the asymmetric reductive amination of ketones
Nat Catal, 2019
1SZO
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CRYSTAL STRUCTURE ANALYSIS OF THE 6-OXO CAMPHOR HYDROLASE HIS122ALA MUTANT BOUND TO ITS NATURAL PRODUCT (2S,4S)-ALPHA-CAMPHOLINIC ACID
Descriptor:6-oxocamphor hydrolase, (2S,4S)-4-(2,2-DIHYDROXYETHYL)-2,3,3-TRIMETHYLCYCLOPENTANONE, CALCIUM ION
Authors:Leonard, P.M., Grogan, G.
Deposit date:2004-04-06
Release date:2004-06-29
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structure of 6-oxo camphor hydrolase H122A mutant bound to its natural product, (2S,4S)-alpha-campholinic acid: mutant structure suggests an atypical mode of transition state binding for a crotonase homolog.
J.Biol.Chem., 279, 2004
3ZGJ
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S221M V223F Y359A MUTANT OF 4-HYDROXYMANDELATE SYNTHASE FROM STREPTOMYCES COELICOLOR
Descriptor:4-HYDROXYPHENYLPYRUVIC ACID DIOXYGENASE, COBALT (II) ION, (R)-MANDELIC ACID
Authors:Pratter, S., Straganz, G., Grogan, G.
Deposit date:2012-12-18
Release date:2013-10-30
Method:X-RAY DIFFRACTION (1.95 Å)
Cite: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
5FJO
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N-ACYL AMINO ACID RACEMASE FROM AMYCOLATOPSIS SP. TS-1-60: G291D- F323Y MUTANT IN COMPLEX WITH N-ACETYL NAPHTHYLALANINE
Descriptor:N-acetyl naphthylalanine, MAGNESIUM ION
Authors:Sanchez-Carron, G., Campopiano, D., Grogan, G.
Deposit date:2015-10-12
Release date:2016-11-16
Method:X-RAY DIFFRACTION (2.08 Å)
Cite: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
Descriptor:O-SUCCINYLBENZOATE SYNTHASE, N-acetyl naphthylalanine, MAGNESIUM ION
Authors:Sanchez Carron, G., Campopiano, D., Grogan, G.
Deposit date:2015-10-12
Release date:2016-11-16
Method:X-RAY DIFFRACTION (2.58 Å)
Cite: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
Descriptor:O-SUCCINYLBENZOATE SYNTHASE, N-acetyl naphthylalanine, MAGNESIUM ION
Authors:Sanchez Carron, G., Campopiano, D., Grogan, G.
Deposit date:2015-10-12
Release date:2016-11-16
Method:X-RAY DIFFRACTION (2.44 Å)
Cite:Structure of N-Acylamino Acid Racemase Mutants in Complex with Substrates
To be Published
5FJT
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N-ACYL AMINO ACID RACEMASE FROM AMYCOLATOPSIS SP. TS-1-60: G291D F323 MUTANT IN COMPLEX WITH N-ACETYL PHENYLALANINE
Descriptor:O-SUCCINYLBENZOATE SYNTHASE, N-acetyl-L-phenylalanine, MAGNESIUM ION
Authors:Sanchez Carron, G., Campopiano, D., Grogan, G.
Deposit date:2015-10-12
Release date:2016-11-23
Method:X-RAY DIFFRACTION (2.11 Å)
Cite:Structure of N-Acylamino Acid Racemase Mutants in Complex with Substrates
To be Published
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
Descriptor:O-SUCCINYLBENZOATE SYNTHASE, MAGNESIUM ION, N-acetyl-L-phenylalanine
Authors:Sanchez Carron, G., Campopiano, D., Grogan, G.
Deposit date:2015-10-13
Release date:2016-11-16
Last modified:2017-09-13
Method:X-RAY DIFFRACTION (2.52 Å)
Cite:Structure of N-Acylamino Acid Racemase Mutants in Complex with Substrates
To be Published
2WIV
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CYTOCHROME-P450 XPLA HEME DOMAIN P21
Descriptor:CYTOCHROME P450-LIKE PROTEIN XPLA, PROTOPORPHYRIN IX CONTAINING FE
Authors:Sabbadin, F., Jackson, R., Bruce, N.C., Grogan, G.
Deposit date:2009-05-18
Release date:2009-08-18
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite: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
2WIY
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CYTOCHROME P450 XPLA HEME DOMAIN P21212
Descriptor:CYTOCHROME P450-LIKE PROTEIN XPLA, IMIDAZOLE, 1,2-ETHANEDIOL, ...
Authors:Sabbadin, F., Jackson, R., Bruce, N.C., Grogan, G.
Deposit date:2009-05-18
Release date:2009-08-18
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.49 Å)
Cite: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
Descriptor:SECONDARY ALCOHOL DEHYDROGENASE, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ZINC ION, ...
Authors:Kroutil, W., Gruber, K., Grogan, G.
Deposit date:2010-03-30
Release date:2010-08-11
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structural Insights Into Substrate Specificity and Solvent Tolerance in Alcohol Dehydrogenase Adh-'A' from Rhodococcus Ruber Dsm 44541.
Chem.Commun.(Camb.), 46, 2010
5A9R
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APO FORM OF IMINE REDUCTASE FROM AMYCOLATOPSIS ORIENTALIS
Descriptor:IMINE REDUCTASE, ACETATE ION
Authors:Man, H., Aleku, G., Turner, N.J., Grogan, G.
Deposit date:2015-07-22
Release date:2016-06-01
Method:X-RAY DIFFRACTION (1.55 Å)
Cite: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
Descriptor:IMINE REDUCTASE, CALCIUM ION, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Man, H., Aleku, G., Turner, N.J., Grogan, G.
Deposit date:2015-07-22
Release date:2016-06-01
Last modified:2018-04-25
Method:X-RAY DIFFRACTION (2.06 Å)
Cite:Stereoselectivity and Structural Characterization of an Imine Reductase (IRED) from Amycolatopsis orientalis
Acs Catalysis, 6, 2016
5A9T
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IMINE REDUCTASE FROM AMYCOLATOPSIS ORIENTALIS IN COMPLEX WITH (R)- METHYLTETRAHYDROISOQUINOLINE
Descriptor:PUTATIVE DEHYDROGENASE, (1R)-1-methyl-1,2,3,4-tetrahydroisoquinoline, CALCIUM ION, ...
Authors:Man, H., Aleku, G., Turner, N.J., Grogan, G.
Deposit date:2015-07-22
Release date:2016-06-01
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Stereoselectivity and Structural Characterization of an Imine Reductase (Ired) from Amycolatopsis Orientalis
Acs Catalysis, 6, 2016
5FWN
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IMINE REDUCTASE FROM AMYCOLATOPSIS ORIENTALIS. CLOSED FORM IN IN COMPLEX WITH (R)- METHYLTETRAHYDROISOQUINOLINE
Descriptor:IMINE REDUCTASE, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, SULFATE ION, ...
Authors:Man, H., Aleku, G., Turner, N.J., Grogan, G.
Deposit date:2016-02-18
Release date:2016-06-01
Last modified:2017-09-06
Method:X-RAY DIFFRACTION (2.14 Å)
Cite:Stereoselectivity and Structural Characterization of an Imine Reductase (Ired) from Amycolatopsis Orientalis
Acs Catalysis, 6, 2016
5G6R
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IMINE REDUCTASE FROM ASPERGILLUS ORYZAE
Descriptor:IMINE REDUCTASE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Man, H., Aleku, G., Turner, N.J., Grogan, G.
Deposit date:2016-06-23
Release date:2017-05-31
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (1.82 Å)
Cite:A reductive aminase from Aspergillus oryzae.
Nat Chem, 9, 2017
5G6S
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IMINE REDUCTASE FROM ASPERGILLUS ORYZAE IN COMPLEX WITH NADP(H) AND (R)-RASAGILINE
Descriptor:IMINE REDUCTASE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, RASAGILINE
Authors:Man, H., Aleku, G., Turner, N.J., Grogan, G.
Deposit date:2016-06-23
Release date:2017-05-31
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:A reductive aminase from Aspergillus oryzae.
Nat Chem, 9, 2017
2J5G
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THE NATIVE STRUCTURE OF A BETA-DIKETONE HYDROLASE FROM THE CYANOBACTERIUM ANABAENA SP. PCC 7120
Descriptor:ALR4455 PROTEIN, SULFATE ION
Authors:Bennett, J.P., Whittingham, J.L., Brzozowski, A.M., Leonard, P.M., Grogan, G.
Deposit date:2006-09-18
Release date:2007-01-16
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.46 Å)
Cite: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
Descriptor:P-HYDROXYCINNAMOYL COA HYDRATASE/LYASE
Authors:Leonard, P.M., Brzozowski, A.M., Lebedev, A., Marshall, C.M., Smith, D.J., Verma, C.S., Walton, N.J., Grogan, G.
Deposit date:2006-09-18
Release date:2006-12-06
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite: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
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
Descriptor:BETA-DIKETONE HYDROLASE, (S)-CYCLOHEXANONE-2-ACETATE, NICKEL (II) ION
Authors:Bennett, J.P., Whittingham, J.L., Brzozowski, A.M., Leonard, P.M., Grogan, G.
Deposit date:2006-09-19
Release date:2007-01-08
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.57 Å)
Cite: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
2UZ1
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1.65 ANGSTROM STRUCTURE OF BENZALDEHYDE LYASE COMPLEXED WITH 2-METHYL- 2,4-PENTANEDIOL
Descriptor:BENZALDEHYDE LYASE, THIAMINE DIPHOSPHATE, (4S)-2-METHYL-2,4-PENTANEDIOL
Authors:Maraite, A., Schmidt, T., Ansorge-Schumacher, M.B., Brzozowski, A.M., Grogan, G.
Deposit date:2007-04-23
Release date:2007-07-24
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Structure of the Thdp-Dependent Enzyme Benzaldehyde Lyase Refined to 1.65 A Resolution.
Acta Crystallogr.,Sect.F, 63, 2007
2VSS
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WILD-TYPE HYDROXYCINNAMOYL-COA HYDRATASE LYASE IN COMPLEX WITH ACETYL- COA AND VANILLIN
Descriptor:P-HYDROXYCINNAMOYL COA HYDRATASE/LYASE, ACETYL COENZYME *A, 4-hydroxy-3-methoxybenzaldehyde
Authors:Bennett, J.P., Bertin, L.M., Brzozowski, A.M., Walton, N.J., Grogan, G.
Deposit date:2008-04-29
Release date:2008-05-27
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.22 Å)
Cite:A Ternary Complex of Hydroxycinnamoyl-Coa Hydratase-Lyase (Hchl) with Acetyl-Coa and Vanillin Gives Insights Into Substrate Specificity and Mechanism.
Biochem.J., 414, 2008
2VSU
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A TERNARY COMPLEX OF HYDROXYCINNAMOYL-COA HYDRATASE-LYASE (HCHL) WITH ACETYL-COENZYME A AND VANILLIN GIVES INSIGHTS INTO SUBSTRATE SPECIFICITY AND MECHANISM.
Descriptor:P-HYDROXYCINNAMOYL COA HYDRATASE/LYASE, ACETYL COENZYME *A, 4-hydroxy-3-methoxybenzaldehyde
Authors:Bennett, J.P., Bertin, L.M., Brzozowski, A.M., Walton, N.J., Grogan, G.
Deposit date:2008-04-29
Release date:2008-05-27
Last modified:2011-08-03
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:A Ternary Complex of Hydroxycinnamoyl-Coa Hydratase-Lyase (Hchl) with Acetyl-Coa and Vanillin Gives Insights Into Substrate Specificity and Mechanism.
Biochem.J., 414, 2008