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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
4AUT
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CRYSTAL STRUCTURE OF THE TUBERCULOSIS DRUG TARGET DECAPRENYL- PHOSPHORYL-BETA-D-RIBOFURANOSE-2-OXIDOREDUCTASE (DPRE1) FROM MYCOBACTERIUM SMEGMATIS
Descriptor:DECAPRENYL-PHOSPHORYL-BETA-D-RIBOFURANOSE-2-OXIDOREDUCTASE, FLAVIN-ADENINE DINUCLEOTIDE
Authors:Neres, J., Pojer, F., Molteni, E., Chiarelli, L.R., Dhar, N., Boy-Rottger, S., Buroni, S., Fullam, E., Degiacomi, G., Lucarelli, A., Read, R.J., Zanoni, G., Edmondson, D.E., De Rossi, E., Pasca, M., Riccardi, G., Mattevi, A., Dyson, P.J., Cole, S.T., Binda, C.
Deposit date:2012-05-21
Release date:2012-09-05
Last modified:2012-09-19
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structural Basis for Benzothiazinone-Mediated Killing of Mycobacterium Tuberculosis.
Sci. Transl. Med., 4, 2012
4CVY
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CRYSTAL STRUCTURE OF THE M. TUBERCULOSIS SULFATE ESTER DIOXYGENASE RV3406 IN COMPLEX WITH IRON.
Descriptor:DIOXYGENASE RV3406/MT3514, NITRATE ION, FE (III) ION
Authors:Neres, J., Hartkoorn, R.C., Chiarelli, L.R., Gadupudi, R., Pasca, M., Mori, G., Farina, D., Salina, S., Makarov, V., Kolly, G.S., Molteni, E., Binda, C., Dhar, N., Ferrari, S., Brodin, P., Delorme, V., Landry, V., de Jesus Lopes Ribeiro, A.L., Saxena, P., Pojer, F., Venturelli, A., Carta, A., Luciani, R., Porta, A., Zanoni, G., De Rossi, E., Costi, M.P., Riccardi, G., Cole, S.T.
Deposit date:2014-03-31
Release date:2014-12-10
Last modified:2015-04-15
Method:X-RAY DIFFRACTION (2 Å)
Cite:2-Carboxyquinoxalines Kill Mycobacterium Tuberculosis Through Noncovalent Inhibition of Dpre1.
Acs Chem.Biol., 10, 2015
4F4Q
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CRYSTAL STRUCTURE OF M. SMEGMATIS DPRE1 IN COMPLEX WITH FAD AND COVALENTLY BOUND BTZ043
Descriptor:DprE1, 8-(hydroxyamino)-2-[(2S)-2-methyl-1,4-dioxa-8-azaspiro[4.5]dec-8-yl]-6-(trifluoromethyl)-4H-1,3-benzothiazin-4-one, FLAVIN-ADENINE DINUCLEOTIDE, ...
Authors:Neres, J., Pojer, F., Molteni, E., Chiarelli, L., Riccardi, G., Mattevi, A., Cole, S.T., Binda, C.
Deposit date:2012-05-11
Release date:2012-09-05
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (2.619 Å)
Cite:Structural Basis for Benzothiazinone-Mediated Killing of Mycobacterium tuberculosis.
Sci Transl Med, 4, 2012
2V57
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CRYSTAL STRUCTURE OF THE TETR-LIKE TRANSCRIPTIONAL REGULATOR LFRR FROM MYCOBACTERIUM SMEGMATIS IN COMPLEX WITH PROFLAVINE
Descriptor:TETR FAMILY TRANSCRIPTIONAL REPRESSOR LFRR, PROFLAVIN, ISOPROPYL ALCOHOL, ...
Authors:Bellinzoni, M., Buroni, S., Riccardi, G., De Rossi, E., Alzari, P.M.
Deposit date:2008-10-02
Release date:2009-10-20
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structural Plasticity and Distinct Drug-Binding Modes of Lfrr, a Mycobacterial Efflux Pump Regulator.
J.Bacteriol., 191, 2009
2WGB
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CRYSTAL STRUCTURE OF THE TETR-LIKE TRANSCRIPTIONAL REGULATOR LFRR FROM MYCOBACTERIUM SMEGMATIS
Descriptor:TETR FAMILY TRANSCRIPTIONAL REPRESSOR LFRR, SULFATE ION
Authors:Bellinzoni, M., Buroni, S., Riccardi, G., De Rossi, E., Alzari, P.M.
Deposit date:2009-04-16
Release date:2009-10-20
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural Plasticity and Distinct Drug-Binding Modes of Lfrr, a Mycobacterial Efflux Pump Regulator.
J.Bacteriol., 191, 2009
5FUS
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CRYSTAL STRUCTURE OF B. CENOCEPACIA DFSA
Descriptor:PUTATIVE ENOYL COA HYDRATASE, SULFATE ION, GLYCEROL, ...
Authors:Spadaro, F., Scoffone, V.C., Chiarelli, L.R., Fumagalli, M., Buroni, S., Riccardi, G., Forneris, F.
Deposit date:2016-01-29
Release date:2016-06-01
Last modified:2016-06-29
Method:X-RAY DIFFRACTION (1.87 Å)
Cite:The Crystal Structure of Burkholderia Cenocepacia Dfsa Provides Insights Into Substrate Recognition and Quorum Sensing Fatty Acid Biosynthesis.
Biochemistry, 55, 2016
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
4NXI
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RV2466C MEDIATES THE ACTIVATION OF TP053 TO KILL REPLICATING AND NON-REPLICATING MYCOBACTERIUM TUBERCULOSIS
Descriptor:Uncharacterized protein, MAGNESIUM ION, 1,2-ETHANEDIOL
Authors:Albesa-Jove, D., Urresti, S., Comino, N., Guerin, M.E.
Deposit date:2013-12-09
Release date:2014-10-22
Method:X-RAY DIFFRACTION (1.698 Å)
Cite:Rv2466c mediates the activation of TP053 to kill replicating and non-replicating Mycobacterium tuberculosis.
Acs Chem.Biol., 9, 2014
4P8C
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CRYSTAL STRUCTURE OF M. TUBERCULOSIS DPRE1 IN COMPLEX WITH THE NON-COVALENT INHIBITOR QN127
Descriptor:Probable decaprenylphosphoryl-beta-D-ribose oxidase, FLAVIN-ADENINE DINUCLEOTIDE, 6-(trifluoromethyl)-3-{[4-(trifluoromethyl)benzyl]amino}quinoxaline-2-carboxylic acid, ...
Authors:Neres, J., Pojer, F., Cole, S.T.
Deposit date:2014-03-31
Release date:2014-12-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:2-Carboxyquinoxalines Kill Mycobacterium tuberculosis through Noncovalent Inhibition of DprE1.
Acs Chem.Biol., 10, 2015
4P8K
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CRYSTAL STRUCTURE OF M. TUBERCULOSIS DPRE1 IN COMPLEX WITH THE NON-COVALENT INHIBITOR TY38C
Descriptor:Probable decaprenylphosphoryl-beta-D-ribose oxidase, FLAVIN-ADENINE DINUCLEOTIDE, 3-[(4-methoxybenzyl)amino]-6-(trifluoromethyl)quinoxaline-2-carboxylic acid
Authors:Neres, J., Pojer, F., Cole, S.T.
Deposit date:2014-03-31
Release date:2014-12-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (2.49 Å)
Cite:2-Carboxyquinoxalines Kill Mycobacterium tuberculosis through Noncovalent Inhibition of DprE1.
Acs Chem.Biol., 10, 2015
4P8L
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CRYSTAL STRUCTURE OF M. TUBERCULOSIS DPRE1 IN COMPLEX WITH THE NON-COVALENT INHIBITOR TY36C
Descriptor:Probable decaprenylphosphoryl-beta-D-ribose oxidase, FLAVIN-ADENINE DINUCLEOTIDE, 3-[(4-fluorobenzyl)amino]-6-(trifluoromethyl)quinoxaline-2-carboxylic acid, ...
Authors:Neres, J., Pojer, F., Cole, S.T.
Deposit date:2014-03-31
Release date:2014-12-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (2.02 Å)
Cite:2-Carboxyquinoxalines Kill Mycobacterium tuberculosis through Noncovalent Inhibition of DprE1.
Acs Chem.Biol., 10, 2015
4P8M
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CRYSTAL STRUCTURE OF M. TUBERCULOSIS DPRE1 IN COMPLEX WITH THE NON-COVALENT INHIBITOR QN114
Descriptor:Probable decaprenylphosphoryl-beta-D-ribose oxidase, FLAVIN-ADENINE DINUCLEOTIDE, 3-[(4-ethoxybenzyl)amino]-6-(trifluoromethyl)quinoxaline-2-carboxylic acid, ...
Authors:Neres, J., Pojer, F., Cole, S.T.
Deposit date:2014-03-31
Release date:2014-12-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:2-Carboxyquinoxalines Kill Mycobacterium tuberculosis through Noncovalent Inhibition of DprE1.
Acs Chem.Biol., 10, 2015
4P8N
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CRYSTAL STRUCTURE OF M. TUBERCULOSIS DPRE1 IN COMPLEX WITH THE NON-COVALENT INHIBITOR QN118
Descriptor:Probable decaprenylphosphoryl-beta-D-ribose oxidase, FLAVIN-ADENINE DINUCLEOTIDE, 3-[(3-fluoro-4-methoxybenzyl)amino]-6-(trifluoromethyl)quinoxaline-2-carboxylic acid, ...
Authors:Neres, J., Pojer, F., Cole, S.T.
Deposit date:2014-03-31
Release date:2014-12-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:2-Carboxyquinoxalines Kill Mycobacterium tuberculosis through Noncovalent Inhibition of DprE1.
Acs Chem.Biol., 10, 2015
4P8P
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CRYSTAL STRUCTURE OF M. TUBERCULOSIS DPRE1 IN COMPLEX WITH THE NON-COVALENT INHIBITOR QN127
Descriptor:Probable decaprenylphosphoryl-beta-D-ribose oxidase, FLAVIN-ADENINE DINUCLEOTIDE, 3-[(4-chlorobenzyl)amino]-6-(trifluoromethyl)quinoxaline-2-carboxylic acid, ...
Authors:Neres, J., Pojer, F., Cole, S.T.
Deposit date:2014-03-31
Release date:2014-12-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:2-Carboxyquinoxalines Kill Mycobacterium tuberculosis through Noncovalent Inhibition of DprE1.
Acs Chem.Biol., 10, 2015
4P8T
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CRYSTAL STRUCTURE OF M. TUBERCULOSIS DPRE1 IN COMPLEX WITH THE NON-COVALENT INHIBITOR QN129
Descriptor:Probable decaprenylphosphoryl-beta-D-ribose oxidase, FLAVIN-ADENINE DINUCLEOTIDE, 3-[(4-cyanobenzyl)amino]-6-(trifluoromethyl)quinoxaline-2-carboxylic acid, ...
Authors:Neres, J., Pojer, F., Cole, S.T.
Deposit date:2014-04-01
Release date:2014-12-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:2-Carboxyquinoxalines Kill Mycobacterium tuberculosis through Noncovalent Inhibition of DprE1.
Acs Chem.Biol., 10, 2015
4P8Y
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CRYSTAL STRUCTURE OF M. TUBERCULOSIS DPRE1 IN COMPLEX WITH THE NON-COVALENT INHIBITOR TY21C
Descriptor:Probable decaprenylphosphoryl-beta-D-ribose oxidase, FLAVIN-ADENINE DINUCLEOTIDE, 3-[(4-methoxybenzyl)amino]-6-(trifluoromethyl)quinoxaline-2-carboxylic acid, ...
Authors:Neres, J., Pojer, F., Cole, S.T.
Deposit date:2014-04-01
Release date:2014-12-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (2.01 Å)
Cite:2-Carboxyquinoxalines Kill Mycobacterium tuberculosis through Noncovalent Inhibition of DprE1.
Acs Chem.Biol., 10, 2015
4ZIL
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CRYSTAL STRUCTURE OF RV2466C AND OXIDOREDUCTASE FROM MYCOBACTERIUM TUBERCULOSIS IN ITS REDUCED STATE
Descriptor:DSBA oxidoreductase, MAGNESIUM ION
Authors:Albesa-Jove, D., Urresti, S., Comino, N., Tersa, M., Guerin, M.E.
Deposit date:2015-04-28
Release date:2015-11-18
Last modified:2016-01-27
Method:X-RAY DIFFRACTION (1.507 Å)
Cite:The Redox State Regulates the Conformation of Rv2466c to Activate the Antitubercular Prodrug TP053.
J.Biol.Chem., 290, 2015