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5F2T
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CRYSTAL STRUCTURE OF MEMBRANE ASSOCIATED PATA FROM MYCOBACTERIUM SMEGMATIS IN COMPLEX WITH PALMITATE - C 2 SPACE GROUP
Descriptor:Phosphatidylinositol mannoside acyltransferase, PALMITIC ACID, MAGNESIUM ION
Authors:Albesa-Jove, D., Svetlikova, Z., Carreras-Gonzalez, A., Tersa, M., Sancho-Vaello, E., Cifuente, J.O., Mikusova, K., Guerin, M.E.
Deposit date:2015-12-02
Release date:2016-03-09
Last modified:2016-03-23
Method:X-RAY DIFFRACTION (2.06 Å)
Cite:Structural basis for selective recognition of acyl chains by the membrane-associated acyltransferase PatA.
Nat Commun, 7, 2016
5F2Z
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CRYSTAL STRUCTURE OF MEMBRANE ASSOCIATED PATA FROM MYCOBACTERIUM SMEGMATIS IN COMPLEX WITH PALMITATE - P21 SPACE GROUP
Descriptor:Phosphatidylinositol mannoside acyltransferase, PALMITIC ACID
Authors:Albesa-Jove, D., Svetlikova, Z., Carreras-Gonzalez, A., Tersa, M., Sancho-Vaello, E., Cifuente, J.O., Mikusova, K., Guerin, M.E.
Deposit date:2015-12-02
Release date:2016-03-09
Last modified:2016-03-23
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Structural basis for selective recognition of acyl chains by the membrane-associated acyltransferase PatA.
Nat Commun, 7, 2016
5F31
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CRYSTAL STRUCTURE OF MEMBRANE ASSOCIATED PATA FROM MYCOBACTERIUM SMEGMATIS IN COMPLEX WITH PALMITATE - P 42 21 2 SPACE GROUP
Descriptor:Phosphatidylinositol mannoside acyltransferase, PALMITIC ACID, ETHANOL, ...
Authors:Albesa-Jove, D., Svetlikova, Z., Carreras-Gonzalez, A., Tersa, M., Sancho-Vaello, E., Cifuente, J.O., Mikusova, K., Guerin, M.E.
Deposit date:2015-12-02
Release date:2016-03-09
Last modified:2016-03-23
Method:X-RAY DIFFRACTION (2.43 Å)
Cite:Structural basis for selective recognition of acyl chains by the membrane-associated acyltransferase PatA.
Nat Commun, 7, 2016
5F34
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CRYSTAL STRUCTURE OF MEMBRANE ASSOCIATED PATA FROM MYCOBACTERIUM SMEGMATIS IN COMPLEX WITH S-HEXADECYL COENZYME A - P21 SPACE GROUP
Descriptor:Phosphatidylinositol mannoside acyltransferase, [[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(3~{S})-4-[[3-(2-hexadecylsulfanylethylamino)-3-oxidanylidene-propyl]amino]-2,2-dimethyl-3-oxidanyl-4-oxidanylidene-butyl] hydrogen phosphate
Authors:Albesa-Jove, D., Svetlikova, Z., Carreras-Gonzalez, A., Tersa, M., Sancho-Vaello, E., Cifuente, J.O., Mikusova, K., Guerin, M.E.
Deposit date:2015-12-02
Release date:2016-03-09
Last modified:2016-03-23
Method:X-RAY DIFFRACTION (3.281 Å)
Cite:Structural basis for selective recognition of acyl chains by the membrane-associated acyltransferase PatA.
Nat Commun, 7, 2016
2GEJ
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CRYSTAL STRUCTURE OF PHOSPHATIDYLINOSITOL MANNOSYLTRANSFERASE (PIMA) FROM MYCOBACTERIUM SMEGMATIS IN COMPLEX WITH GDP-MAN
Descriptor:PHOSPHATIDYLINOSITOL MANNOSYLTRANSFERASE (PimA), GUANOSINE-5'-DIPHOSPHATE-ALPHA-D-MANNOSE
Authors:Guerin, M.E., Buschiazzo, A., Kordulakova, J., Jackson, M., Alzari, P.M.
Deposit date:2006-03-20
Release date:2007-04-03
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Molecular recognition and interfacial catalysis by the essential phosphatidylinositol mannosyltransferase PimA from mycobacteria.
J.Biol.Chem., 282, 2007
2GEK
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CRYSTAL STRUCTURE OF PHOSPHATIDYLINOSITOL MANNOSYLTRANSFERASE (PIMA) FROM MYCOBACTERIUM SMEGMATIS IN COMPLEX WITH GDP
Descriptor:PHOSPHATIDYLINOSITOL MANNOSYLTRANSFERASE (PimA), GUANOSINE-5'-DIPHOSPHATE
Authors:Guerin, M.E., Buschiazzo, A., Kordulakova, J., Jackson, M., Alzari, P.M.
Deposit date:2006-03-20
Release date:2007-04-03
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Molecular recognition and interfacial catalysis by the essential phosphatidylinositol mannosyltransferase PimA from mycobacteria.
J.Biol.Chem., 282, 2007
4KW5
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M. TUBERCULOSIS DPRE1 IN COMPLEX WITH INHIBITOR TCA1
Descriptor:Oxidoreductase, FLAVIN-ADENINE DINUCLEOTIDE, ethyl ({2-[(1,3-benzothiazol-2-ylcarbonyl)amino]thiophen-3-yl}carbonyl)carbamate, ...
Authors:Batt, S.M., Besra, G.S., Futterer, K.
Deposit date:2013-05-23
Release date:2013-07-10
Last modified:2013-07-17
Method:X-RAY DIFFRACTION (2.612 Å)
Cite:Identification of a small molecule with activity against drug-resistant and persistent tuberculosis.
Proc.Natl.Acad.Sci.USA, 110, 2013
6DDP
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MYCOBACTERIUM TUBERCULOSIS DIHYDROFOLATE REDUCTASE COMPLEXED WITH BETA-NADPH AND 3'-[(2R)-4-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)BUT-3-YN-2-YL]-5'-METHOXY[1,1'-BIPHENYL]-4-CARBOXYLIC ACID
Descriptor:Dihydrofolate reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 3'-[(2R)-4-(2,4-diamino-6-ethylpyrimidin-5-yl)but-3-yn-2-yl]-5'-methoxy[1,1'-biphenyl]-4-carboxylic acid
Authors:Hajian, B., Wright, D.
Deposit date:2018-05-10
Release date:2018-05-23
Last modified:2019-07-10
Method:X-RAY DIFFRACTION (1.49 Å)
Cite:Drugging the Folate Pathway in Mycobacterium tuberculosis: The Role of Multi-targeting Agents.
Cell Chem Biol, 26, 2019
6DDS
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MYCOBACTERIUM TUBERCULOSIS DIHYDROFOLATE REDUCTASE COMPLEXED WITH BETA-NADPH AND 4-[3-[3-[2,4-BIS(AZANYL)-6-ETHYL-PYRIMIDIN-5-YL]PROP-2-YNYL]-5-METHOXY-PHENYL]BENZOIC ACID
Descriptor:Dihydrofolate reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 4-[3-[3-[2,4-bis(azanyl)-6-ethyl-pyrimidin-5-yl]prop-2-ynyl]-5-methoxy-phenyl]benzoic acid, ...
Authors:Hajian, B., Wright, D., Scocchera, E.
Deposit date:2018-05-10
Release date:2018-05-23
Last modified:2019-07-10
Method:X-RAY DIFFRACTION (1.72 Å)
Cite:Drugging the Folate Pathway in Mycobacterium tuberculosis: The Role of Multi-targeting Agents.
Cell Chem Biol, 26, 2019
6DDW
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MYCOBACTERIUM TUBERCULOSIS DIHYDROFOLATE REDUCTASE COMPLEXED WITH BETA-NADPH AND N-(4-{[(2-AMINO-4-OXO-3,4-DIHYDROPTERIDIN-6-YL)METHYL]AMINO}-2-HYDROXYBENZENE-1-CARBONYL)-L-GLUTAMIC ACID
Descriptor:Dihydrofolate reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, N-(4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}-2-hydroxybenzene-1-carbonyl)-L-glutamic acid, ...
Authors:Hajian, B., Scocchera, E., Wright, D.
Deposit date:2018-05-10
Release date:2018-05-23
Last modified:2019-07-10
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Drugging the Folate Pathway in Mycobacterium tuberculosis: The Role of Multi-targeting Agents.
Cell Chem Biol, 26, 2019
6DE4
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HOMO SAPIENS DIHYDROFOLATE REDUCTASE COMPLEXED WITH BETA-NADPH AND 3'-[(2R)-4-(2,4-DIAMINO-6-ETHYLPHENYL)BUT-3-YN-2-YL]-5'-METHOXY-[1,1'-BIPHENYL]-4-CARBOXYLIC ACID
Descriptor:Dihydrofolate reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 3'-[(2R)-4-(2,4-diamino-6-ethylpyrimidin-5-yl)but-3-yn-2-yl]-5'-methoxy[1,1'-biphenyl]-4-carboxylic acid, ...
Authors:Hajian, B., Wright, D.
Deposit date:2018-05-11
Release date:2018-05-23
Last modified:2019-07-10
Method:X-RAY DIFFRACTION (2.411 Å)
Cite:Drugging the Folate Pathway in Mycobacterium tuberculosis: The Role of Multi-targeting Agents.
Cell Chem Biol, 26, 2019
6DE5
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MYCOBACTERIUM TUBERCULOSIS RV2671 COMPLEXED WITH BETA-NADPH AND 6-ETHYL-5-{(3S)-3-[2-METHOXY-5-(PYRIDIN-4-YL)PHENYL]BUT-1-YN-1-YL}PYRIMIDINE-2,4-DIAMINE
Descriptor:riboflavin biosynthesis protein RibD, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 6-ethyl-5-{(3S)-3-[2-methoxy-5-(pyridin-4-yl)phenyl]but-1-yn-1-yl}pyrimidine-2,4-diamine
Authors:Hajian, B., Wright, D.
Deposit date:2018-05-11
Release date:2018-05-23
Last modified:2019-07-10
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Drugging the Folate Pathway in Mycobacterium tuberculosis: The Role of Multi-targeting Agents.
Cell Chem Biol, 26, 2019
2WZV
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CRYSTAL STRUCTURE OF THE FMN-DEPENDENT NITROREDUCTASE NFNB FROM MYCOBACTERIUM SMEGMATIS
Descriptor:NFNB PROTEIN, FLAVIN MONONUCLEOTIDE, PHOSPHATE ION, ...
Authors:Bellinzoni, M., Manina, G., Riccardi, G., Alzari, P.M.
Deposit date:2009-12-03
Release date:2010-07-14
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Biological and Structural Characterization of the Mycobacterium Smegmatis Nitroreductase Nfnb, and its Role in Benzothiazinone Resistance
Mol.Microbiol., 77, 2010
2WZW
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CRYSTAL STRUCTURE OF THE FMN-DEPENDENT NITROREDUCTASE NFNB FROM MYCOBACTERIUM SMEGMATIS IN COMPLEX WITH NADPH
Descriptor:NFNB PROTEIN, FLAVIN MONONUCLEOTIDE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Bellinzoni, M., Manina, G., Riccardi, G., Alzari, P.M.
Deposit date:2009-12-03
Release date:2010-07-14
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Biological and Structural Characterization of the Mycobacterium Smegmatis Nitroreductase Nfnb, and its Role in Benzothiazinone Resistance
Mol.Microbiol., 77, 2010
4ZDI
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CRYSTAL STRUCTURE OF THE M. TUBERCULOSIS CTP SYNTHASE PYRG (APO FORM)
Descriptor:CTP synthase, CALCIUM ION
Authors:Bellinzoni, M., Barilone, N., Alzari, P.M.
Deposit date:2015-04-17
Release date:2015-07-01
Last modified:2015-08-05
Method:X-RAY DIFFRACTION (3.52 Å)
Cite:Thiophenecarboxamide Derivatives Activated by EthA Kill Mycobacterium tuberculosis by Inhibiting the CTP Synthetase PyrG.
Chem.Biol., 22, 2015
4ZDJ
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CRYSTAL STRUCTURE OF THE M. TUBERCULOSIS CTP SYNTHASE PYRG IN COMPLEX WITH TWO UTP MOLECULES
Descriptor:CTP synthase, URIDINE 5'-TRIPHOSPHATE, MAGNESIUM ION, ...
Authors:Bellinzoni, M., Barilone, N., Alzari, P.M.
Deposit date:2015-04-17
Release date:2015-07-01
Last modified:2015-08-05
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Thiophenecarboxamide Derivatives Activated by EthA Kill Mycobacterium tuberculosis by Inhibiting the CTP Synthetase PyrG.
Chem.Biol., 22, 2015
4ZDK
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CRYSTAL STRUCTURE OF THE M. TUBERCULOSIS CTP SYNTHASE PYRG IN COMPLEX WITH UTP, AMP-PCP AND OXONORLEUCINE
Descriptor:CTP synthase, 5-OXO-L-NORLEUCINE, PHOSPHOMETHYLPHOSPHONIC ACID ADENYLATE ESTER, ...
Authors:Bellinzoni, M., Barilone, N., Alzari, P.M.
Deposit date:2015-04-17
Release date:2015-07-01
Last modified:2015-08-05
Method:X-RAY DIFFRACTION (3.49 Å)
Cite:Thiophenecarboxamide Derivatives Activated by EthA Kill Mycobacterium tuberculosis by Inhibiting the CTP Synthetase PyrG.
Chem.Biol., 22, 2015