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2VZZ
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BU of 2vzz by Molmil
Crystal structure of Rv0802c from Mycobacterium tuberculosis in Complex with Succinyl-CoA
Descriptor: RV0802C, SUCCINYL-COENZYME A
Authors:Vetting, M.W, Errey, J.C, Blanchard, J.S.
Deposit date:2008-08-07
Release date:2009-04-07
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Rv0802C from Mycobacterium Tuberculosis: The First Structure of a Succinyltransferase with the Gnat Fold.
Acta Crystallogr.,Sect.F, 64, 2008
2VQY
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BU of 2vqy by Molmil
Structure of AAC(6')-Ib in complex with Parmomycin and AcetylCoA.
Descriptor: AAC(6')-IB, ACETYL COENZYME *A, CALCIUM ION, ...
Authors:Vetting, M.W, Park, C.H, Hedge, S.S, Hooper, D.C, Blanchard, J.S.
Deposit date:2008-03-20
Release date:2008-09-02
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Mechanistic and Structural Analysis of Aminoglycoside N-Acetyltransferase Aac(6')-Ib and its Bifunctional, Fluoroquinolone-Active Aac(6')-Ib-Cr Variant.
Biochemistry, 47, 2008
2X9Q
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BU of 2x9q by Molmil
Structure of the Mycobacterium tuberculosis protein, Rv2275, demonstrates that cyclodipeptide synthetases are related to type I tRNA-Synthetases.
Descriptor: CYCLODIPEPTIDE SYNTHETASE
Authors:Vetting, M.W, Hegde, S.S, Blanchard, J.S.
Deposit date:2010-03-23
Release date:2010-09-22
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.02 Å)
Cite:The Structure and Mechanism of the Mycobacterium Tuberculosis Cyclodityrosine Synthetase.
Nat.Chem.Biol., 6, 2010
3IQA
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BU of 3iqa by Molmil
Crystal Structure of BlaC covalently bound with Doripenem
Descriptor: (2S,3R,4S)-2-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-3-methyl-4-({(3S,5S)-5-[(sulfamoylamino)methyl]pyrrolidin-3-yl}sulfanyl)-3,4-dihydro-2H-pyrrole-5-carboxylic acid, Beta-lactamase, PHOSPHATE ION
Authors:Tremblay, L.W, Blanchard, J.S.
Deposit date:2009-08-19
Release date:2010-04-14
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Biochemical and structural characterization of Mycobacterium tuberculosis beta-lactamase with the carbapenems ertapenem and doripenem.
Biochemistry, 49, 2010
3M6B
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BU of 3m6b by Molmil
Crystal Structure of the Ertapenem Pre-isomerized Covalent Adduct with TB B-lactamase
Descriptor: (4R,5S)-3-({(3S,5S)-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl}sulfanyl)-5-[(1S,2R)-1-formyl-2-hydroxypropyl]-4-methyl-4,5-dihydro-1H-pyrrole-2-carboxylic acid, Beta-lactamase, PHOSPHATE ION
Authors:Tremblay, L.W, Fan, F, Blanchard, J.S.
Deposit date:2010-03-15
Release date:2010-04-14
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Biochemical and structural characterization of Mycobacterium tuberculosis beta-lactamase with the carbapenems ertapenem and doripenem.
Biochemistry, 49, 2010
3N8S
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BU of 3n8s by Molmil
Crystal Structure of BlaC-E166A covalently bound with Cefamandole
Descriptor: (2R)-2-[(1R)-1-{[(2R)-2-hydroxy-2-phenylacetyl]amino}-2-oxoethyl]-5-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid, Beta-lactamase, PHOSPHATE ION
Authors:Tremblay, L.W, Blanchard, J.S.
Deposit date:2010-05-28
Release date:2010-11-24
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structures of the Michaelis Complex (1.2 A) and the Covalent Acyl Intermediate (2.0 A) of Cefamandole Bound in the Active Sites of the Mycobacterium tuberculosis beta-Lactamase K73A and E166A Mutants.
Biochemistry, 49, 2010
3N6I
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BU of 3n6i by Molmil
Crystal Structure of BlaC-E166A covalently bound with 6-aminopenicillian
Descriptor: (2R,4S)-2-[(1R)-1-amino-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, Beta-lactamase, PHOSPHATE ION
Authors:Tremblay, L.W, Blanchard, J.S.
Deposit date:2010-05-25
Release date:2011-12-14
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2 Å)
Cite:The Structure Activity Relationship of BlaC with all classes of beta-lactams
To be Published
3N8R
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BU of 3n8r by Molmil
Crystal Structure of BlaC-E166A covalently bound with Carbenicillin
Descriptor: (2R,4S)-2-[(1R)-1-{[(2S)-2-carboxy-2-phenylacetyl]amino}-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, Beta-lactamase, PHOSPHATE ION
Authors:Tremblay, L.W, Blanchard, J.S.
Deposit date:2010-05-28
Release date:2011-12-14
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.41 Å)
Cite:BlaC-E166A bound with beta-lactams from all classes
To be Published
3NDG
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BU of 3ndg by Molmil
Crystal Structure of BlaC-E166A covalently bound with Methicillin
Descriptor: (2R,4S)-2-[(1R)-1-{[(2,6-dimethoxyphenyl)carbonyl]amino}-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, Beta-lactamase, PHOSPHATE ION
Authors:Tremblay, L.W, Blanchard, J.S.
Deposit date:2010-06-07
Release date:2011-12-14
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:BlaC-E166A covalently bound with cephalosporins and penicillins
To be Published
3NBL
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BU of 3nbl by Molmil
Crystal Structure of BlaC-E166A covalently bound with Cefuroxime
Descriptor: (2R)-5-[(carbamoyloxy)methyl]-2-[(1R)-1-{[(2Z)-2-(furan-2-yl)-2-(methoxyimino)acetyl]amino}-2-oxoethyl]-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid, Beta-lactamase
Authors:Tremblay, L.W, Blanchard, J.S.
Deposit date:2010-06-03
Release date:2011-12-14
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2 Å)
Cite:BlaC-E166A covalently bound with cephalosporins and penicillins
To be Published
3N8L
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BU of 3n8l by Molmil
Crystal Structure of BlaC-E166A covalently bound with Ampicillin
Descriptor: (2R,4S)-2-[(1R)-1-{[(2R)-2-amino-2-phenylacetyl]amino}-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, Beta-lactamase, PHOSPHATE ION
Authors:Tremblay, L.W, Blanchard, J.S.
Deposit date:2010-05-28
Release date:2011-12-14
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Structures of BlaC-E166A covalently bound to beta-lactams from all classes.
To be Published
3N7W
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BU of 3n7w by Molmil
Crystal Structure of BlaC-E166A covalently bound with Amoxicillin
Descriptor: 2-{1-[2-AMINO-2-(4-HYDROXY-PHENYL)-ACETYLAMINO]-2-OXO-ETHYL}-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID, Beta-lactamase, PHOSPHATE ION
Authors:Tremblay, L.W, Blanchard, J.S.
Deposit date:2010-05-27
Release date:2011-12-14
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:BlaC-E166A Bound with btea-lactams of all classes
To be Published
3NDE
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BU of 3nde by Molmil
Crystal Structure of BlaC-E166A covalently bound with Cephalotin
Descriptor: (2R)-5-[(acetyloxy)methyl]-2-{(1R)-2-oxo-1-[(thiophen-2-ylacetyl)amino]ethyl}-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid, Beta-lactamase, PHOSPHATE ION
Authors:Tremblay, L.W, Blanchard, J.S.
Deposit date:2010-06-07
Release date:2011-12-14
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:BlaC-E166A covalently bound with cephalosporins and penicillins
To be Published
3NCK
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BU of 3nck by Molmil
Crystal Structure of BlaC-E166A covalently bound with Nafcillin
Descriptor: (2R,4S)-2-[(1R)-1-{[(2-ethoxynaphthalen-1-yl)carbonyl]amino}-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, Beta-lactamase
Authors:Tremblay, L.W, Blanchard, J.S.
Deposit date:2010-06-04
Release date:2011-12-14
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:BlaC-E166A covalently bound with cephalosporins and penicillins
To be Published
3NC8
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BU of 3nc8 by Molmil
Crystal Structure of BlaC-E166A covalently bound with Mecillinam
Descriptor: 2-[(1R)-1-{[(E)-azepan-1-ylmethylidene]amino}-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, Beta-lactamase, PHOSPHATE ION
Authors:Tremblay, L.W, Blanchard, J.S.
Deposit date:2010-06-04
Release date:2011-12-14
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:BlaC-E166A covalently bound with cephalosporins and penicillins
To be Published
6OVT
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BU of 6ovt by Molmil
Crystal Structure of IlvD from Mycobacterium tuberculosis
Descriptor: DI(HYDROXYETHYL)ETHER, Dihydroxy-acid dehydratase, FE2/S2 (INORGANIC) CLUSTER, ...
Authors:Almo, S.C, Grove, T.L, Bonanno, J.B, Baker, E.N, Bashiri, G.
Deposit date:2019-05-08
Release date:2019-08-07
Last modified:2019-12-18
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:The active site of theMycobacterium tuberculosisbranched-chain amino acid biosynthesis enzyme dihydroxyacid dehydratase contains a 2Fe-2S cluster.
J.Biol.Chem., 294, 2019
4DF6
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BU of 4df6 by Molmil
Crystal Structure of the inhibitor NXL104 Covalent Adduct with TB B-lactamase
Descriptor: (2S,5R)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide, Beta-lactamase, PHOSPHATE ION
Authors:Hazra, S, Blanchard, J.
Deposit date:2012-01-23
Release date:2012-07-18
Last modified:2015-06-03
Method:X-RAY DIFFRACTION (2.29 Å)
Cite:NXL104 irreversibly inhibits the {beta}-lactamase from Mycobacterium tuberculosis.
Biochemistry, 51, 2012
4Q8I
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BU of 4q8i by Molmil
Crystal Structure of beta-lactamase from M.tuberculosis covalently complexed with Tebipenem
Descriptor: (4R,5S)-3-(1-(4,5-dihydrothiazol-2-yl)azetidin-3-ylthio)-5-((2S,3R)-3-hydroxy-1-oxobutan-2-yl)-4-methyl-4,5- dihydro-1H-pyrrole-2-carboxylic acid, Beta-lactamase, PHOSPHATE ION
Authors:Hazra, S, Blanchard, J.
Deposit date:2014-04-27
Release date:2014-08-20
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.901 Å)
Cite:Tebipenem, a new carbapenem antibiotic, is a slow substrate that inhibits the beta-lactamase from Mycobacterium tuberculosis.
Biochemistry, 53, 2014
4QHC
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BU of 4qhc by Molmil
Structure of M.Tuberculosis Betalactamase (Blac) with inhibitor having novel mechanism
Descriptor: (3R,6R,7S)-7-[(2R,3aR)-hexahydropyrazolo[1,5-c][1,3]thiazin-2-yl]-6-(hydroxymethyl)-1,4-thiazepane-3-carboxylic acid, Beta-lactamase, PHOSPHATE ION
Authors:Hazra, S, Blanchard, J.
Deposit date:2014-05-28
Release date:2015-07-22
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.899 Å)
Cite:Kinetic and Structural Characterization of the Interaction of 6-Methylidene Penem 2 with the beta-Lactamase from Mycobacterium tuberculosis.
Biochemistry, 54, 2015
4QB8
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BU of 4qb8 by Molmil
Crystal Structure of beta-lactamase from M.tuberculosis forming Michaelis Menten with Tebipenem
Descriptor: Beta-lactamase, PHOSPHATE ION, TEBIPENEM
Authors:Hazra, S, Blanchard, J.
Deposit date:2014-05-06
Release date:2014-08-20
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.758 Å)
Cite:Tebipenem, a new carbapenem antibiotic, is a slow substrate that inhibits the beta-lactamase from Mycobacterium tuberculosis.
Biochemistry, 53, 2014
4HCX
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BU of 4hcx by Molmil
Structure of ICDH-1 from M.tuberculosis complexed with NADPH & Mn2+
Descriptor: CHLORIDE ION, Isocitrate dehydrogenase [NADP], MANGANESE (II) ION, ...
Authors:Hazra, S, Blanchard, J.
Deposit date:2012-10-01
Release date:2013-02-27
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.18 Å)
Cite:Structural, Kinetic and Chemical Mechanism of Isocitrate Dehydrogenase-1 from Mycobacterium tuberculosis.
Biochemistry, 52, 2013
1BXG
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BU of 1bxg by Molmil
PHENYLALANINE DEHYDROGENASE STRUCTURE IN TERNARY COMPLEX WITH NAD+ AND BETA-PHENYLPROPIONATE
Descriptor: HYDROCINNAMIC ACID, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, PHENYLALANINE DEHYDROGENASE, ...
Authors:Vanhooke, J.L, Thoden, J.B, Brunhuber, N.M.W, Blanchard, J.L, Holden, H.M.
Deposit date:1998-10-02
Release date:1999-05-18
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Phenylalanine dehydrogenase from Rhodococcus sp. M4: high-resolution X-ray analyses of inhibitory ternary complexes reveal key features in the oxidative deamination mechanism.
Biochemistry, 38, 1999
1BW9
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BU of 1bw9 by Molmil
PHENYLALANINE DEHYDROGENASE STRUCTURE IN TERNARY COMPLEX WITH NAD+ AND PHENYLPYRUVATE
Descriptor: 1,2-ETHANEDIOL, 3-PHENYLPYRUVIC ACID, ISOPROPYL ALCOHOL, ...
Authors:Vanhooke, J.L, Thoden, J.B, Brunhuber, N.M.W, Blanchard, J.L, Holden, H.M.
Deposit date:1998-10-01
Release date:1999-05-18
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Phenylalanine dehydrogenase from Rhodococcus sp. M4: high-resolution X-ray analyses of inhibitory ternary complexes reveal key features in the oxidative deamination mechanism.
Biochemistry, 38, 1999
4X6T
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BU of 4x6t by Molmil
M.tuberculosis betalactamase complexed with inhibitor EC19
Descriptor: 3-[(2R)-2-(dihydroxyboranyl)-2-{[(2R)-2-{[(4-ethyl-2,3-dioxo-3,4-dihydropyrazin-1(2H)-yl)carbonyl]amino}-2-(4-hydroxyphenyl)acetyl]amino}ethyl]benzoic acid, Beta-lactamase, PHOSPHATE ION
Authors:Hazra, S.
Deposit date:2014-12-09
Release date:2015-12-23
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Inhibiting the beta-Lactamase of Mycobacterium tuberculosis (Mtb) with Novel Boronic Acid Transition-State Inhibitors (BATSIs).
ACS Infect Dis, 1, 2015
1C1X
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BU of 1c1x by Molmil
L-PHENYLALANINE DEHYDROGENASE STRUCTURE IN TERNARY COMPLEX WITH NAD+ AND L-3-PHENYLLACTATE
Descriptor: ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID, ISOPROPYL ALCOHOL, L-PHENYLALANINE DEHYDROGENASE, ...
Authors:Vanhooke, J.L, Thoden, J.B.
Deposit date:1999-07-22
Release date:2000-08-30
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Rhodococcus L-phenylalanine dehydrogenase: kinetics, mechanism, and structural basis for catalytic specificity.
Biochemistry, 39, 2000

219869

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