4BQP
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![BU of 4bqp by Molmil](/molmil-images/mine/4bqp) | Mtb InhA complex with Methyl-thiazole compound 7 | Descriptor: | (1S)-1-(5-{[1-(2,6-DIFLUOROBENZYL)-1H-PYRAZOL-3-YL]AMINO}-1,3,4-THIADIAZOL-2-YL)-1-(4-METHYL-1,3-THIAZOL-2-YL)ETHANOL, ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADH], NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ... | Authors: | Read, J.A, Gingell, H, Madhavapeddi, P, Shirude, P.S. | Deposit date: | 2013-05-31 | Release date: | 2013-12-11 | Last modified: | 2024-05-08 | Method: | X-RAY DIFFRACTION (1.89 Å) | Cite: | Methyl-Thiazoles: A Novel Mode of Inhibition with the Potential to Develop Novel Inhibitors Targeting Inha in Mycobacterium Tuberculosis. J.Med.Chem., 56, 2013
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4BQR
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![BU of 4bqr by Molmil](/molmil-images/mine/4bqr) | Mtb InhA complex with Methyl-thiazole compound 11 | Descriptor: | (NZ)-2-[2,6-bis(fluoranyl)phenyl]-N-[5-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)-1-oxidanyl-ethyl]-3H-1,3,4-thiadiazol-2-ylidene]ethanamide, ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADH], NICOTINAMIDE-ADENINE-DINUCLEOTIDE | Authors: | Read, J.A, Gingell, H, Madhavapeddi, P, Shirude, P.S. | Deposit date: | 2013-05-31 | Release date: | 2013-12-11 | Last modified: | 2024-05-08 | Method: | X-RAY DIFFRACTION (2.05 Å) | Cite: | Methyl-Thiazoles: A Novel Mode of Inhibition with the Potential to Develop Novel Inhibitors Targeting Inha in Mycobacterium Tuberculosis. J.Med.Chem., 56, 2013
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4KEH
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![BU of 4keh by Molmil](/molmil-images/mine/4keh) | Crosslinked Crystal Structure of Type II Fatty Synthase Dehydratase, FabA, and Acyl Carrier Protein, AcpP | Descriptor: | Acyl carrier protein, N-{3-[DIHYDROXY(NONYL)-LAMBDA~4~-SULFANYL]PROPYL}-N~3~-[(2R)-2-HYDROXY-3,3-DIMETHYL-4-(PHOSPHONOOXY)BUTANOYL]-BETA-ALANINAMIDE, N-{3-[dihydroxy(nonyl)-lambda~4~-sulfanyl]propyl}-N~3~-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alaninamide | Authors: | Nguyen, C, Haushalter, R, Finzel, K, Leong, J, Le, B.C, Burkart, M, Tsai, S.C. | Deposit date: | 2013-04-25 | Release date: | 2013-12-25 | Last modified: | 2014-01-29 | Method: | X-RAY DIFFRACTION (1.901 Å) | Cite: | Trapping the dynamic acyl carrier protein in fatty acid biosynthesis. Nature, 505, 2014
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4KIS
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![BU of 4kis by Molmil](/molmil-images/mine/4kis) | Crystal Structure of a LSR-DNA Complex | Descriptor: | CALCIUM ION, DNA (26-MER), Putative integrase [Bacteriophage A118], ... | Authors: | Rutherford, K, Yuan, P, Perry, K, Van Duyne, G.D. | Deposit date: | 2013-05-02 | Release date: | 2013-07-10 | Last modified: | 2024-02-28 | Method: | X-RAY DIFFRACTION (3.2 Å) | Cite: | Attachment site recognition and regulation of directionality by the serine integrases. Nucleic Acids Res., 41, 2013
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4LMS
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![BU of 4lms by Molmil](/molmil-images/mine/4lms) | Light harvesting complex PC645 from the cryptophyte Chroomonas sp. CCMP270 | Descriptor: | 15,16-DIHYDROBILIVERDIN, HEXAETHYLENE GLYCOL, PHYCOCYANOBILIN, ... | Authors: | Harrop, S.J, Wilk, K.E, Curmi, P.M.G. | Deposit date: | 2013-07-11 | Release date: | 2014-06-18 | Last modified: | 2023-09-20 | Method: | X-RAY DIFFRACTION (1.35 Å) | Cite: | Single-residue insertion switches the quaternary structure and exciton states of cryptophyte light-harvesting proteins. Proc.Natl.Acad.Sci.USA, 111, 2014
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4LM6
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![BU of 4lm6 by Molmil](/molmil-images/mine/4lm6) | Light harvesting complex PC612 from the cryptophyte Hemiselmis virescens M1635 | Descriptor: | 15,16-DIHYDROBILIVERDIN, PHYCOCYANOBILIN, cryptophyte phycocyanin alpha chain, ... | Authors: | Harrop, S.J, Wilk, K.E, Curmi, P.M.G. | Deposit date: | 2013-07-10 | Release date: | 2014-06-18 | Last modified: | 2023-09-20 | Method: | X-RAY DIFFRACTION (1.7 Å) | Cite: | Single-residue insertion switches the quaternary structure and exciton states of cryptophyte light-harvesting proteins. Proc.Natl.Acad.Sci.USA, 111, 2014
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4LMX
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![BU of 4lmx by Molmil](/molmil-images/mine/4lmx) | Light harvesting complex PE555 from the cryptophyte Hemiselmis andersenii CCMP644 | Descriptor: | 15,16-DIHYDROBILIVERDIN, PHYCOERYTHROBILIN, cryptophyte phycoerythrin (alpha-1 chain), ... | Authors: | Harrop, S.J, Wilk, K.E, Curmi, P.M.G. | Deposit date: | 2013-07-11 | Release date: | 2014-06-18 | Last modified: | 2023-09-20 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | Single-residue insertion switches the quaternary structure and exciton states of cryptophyte light-harvesting proteins. Proc.Natl.Acad.Sci.USA, 111, 2014
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4KSS
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![BU of 4kss by Molmil](/molmil-images/mine/4kss) | Crystal Structure of Vibrio cholerae ATPase GspsE Hexamer | Descriptor: | Type II secretion system protein E, hemolysin-coregulated protein | Authors: | Hol, W.G, Turley, S, Lu, C.Y, Park, Y.J. | Deposit date: | 2013-05-17 | Release date: | 2013-09-04 | Last modified: | 2024-02-28 | Method: | X-RAY DIFFRACTION (7.58 Å) | Cite: | Hexamers of the Type II Secretion ATPase GspE from Vibrio cholerae with Increased ATPase Activity. Structure, 21, 2013
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7W22
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![BU of 7w22 by Molmil](/molmil-images/mine/7w22) | Structure of the M. tuberculosis HtrA K436A mutant | Descriptor: | Probable serine protease HtrA1 | Authors: | Gupta, A.K, Gopal, B. | Deposit date: | 2021-11-21 | Release date: | 2022-11-23 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (2.01 Å) | Cite: | Allosteric Determinants in High Temperature Requirement A Enzymes Are Conserved and Regulate the Population of Active Conformations. Acs Chem.Biol., 18, 2023
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7W25
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![BU of 7w25 by Molmil](/molmil-images/mine/7w25) | Structure of the M. tuberculosis HtrA S413A mutant | Descriptor: | Probable serine protease HtrA1 | Authors: | Gupta, A.K, Gopal, B. | Deposit date: | 2021-11-21 | Release date: | 2022-11-23 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (2.65 Å) | Cite: | Allosteric Determinants in High Temperature Requirement A Enzymes Are Conserved and Regulate the Population of Active Conformations. Acs Chem.Biol., 18, 2023
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7W23
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![BU of 7w23 by Molmil](/molmil-images/mine/7w23) | Structure of the M. tuberculosis HtrA S363A mutant | Descriptor: | Probable serine protease HtrA1 | Authors: | Gupta, A.K, Gopal, B. | Deposit date: | 2021-11-21 | Release date: | 2022-11-23 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (1.9 Å) | Cite: | Allosteric Determinants in High Temperature Requirement A Enzymes Are Conserved and Regulate the Population of Active Conformations. Acs Chem.Biol., 18, 2023
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7W24
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![BU of 7w24 by Molmil](/molmil-images/mine/7w24) | Structure of the M. tuberculosis HtrA N383A mutant | Descriptor: | Probable serine protease HtrA1 | Authors: | Gupta, A.K, Gopal, B. | Deposit date: | 2021-11-21 | Release date: | 2022-11-23 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (2.9 Å) | Cite: | Allosteric Determinants in High Temperature Requirement A Enzymes Are Conserved and Regulate the Population of Active Conformations. Acs Chem.Biol., 18, 2023
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7VZ0
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![BU of 7vz0 by Molmil](/molmil-images/mine/7vz0) | Structure of the M. tuberculosis HtrA S407A mutant | Descriptor: | Probable serine protease HtrA1 | Authors: | Gupta, A.K, Gopal, B. | Deposit date: | 2021-11-15 | Release date: | 2022-11-23 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (1.95 Å) | Cite: | Allosteric Determinants in High Temperature Requirement A Enzymes Are Conserved and Regulate the Population of Active Conformations. Acs Chem.Biol., 18, 2023
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7W21
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![BU of 7w21 by Molmil](/molmil-images/mine/7w21) | Structure of the M. tuberculosis HtrA N269A mutant | Descriptor: | Probable serine protease HtrA1 | Authors: | Gupta, A.K, Gopal, B. | Deposit date: | 2021-11-21 | Release date: | 2022-11-23 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (2 Å) | Cite: | Allosteric Determinants in High Temperature Requirement A Enzymes Are Conserved and Regulate the Population of Active Conformations. Acs Chem.Biol., 18, 2023
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7VYZ
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![BU of 7vyz by Molmil](/molmil-images/mine/7vyz) | Structure of the M. tuberculosis HtrA S367A mutant | Descriptor: | Probable serine protease HtrA1 | Authors: | Gupta, A.K, Gopal, B. | Deposit date: | 2021-11-15 | Release date: | 2022-11-23 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (2.401 Å) | Cite: | Allosteric Determinants in High Temperature Requirement A Enzymes Are Conserved and Regulate the Population of Active Conformations. Acs Chem.Biol., 18, 2023
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7W4R
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![BU of 7w4r by Molmil](/molmil-images/mine/7w4r) | |
7W4W
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![BU of 7w4w by Molmil](/molmil-images/mine/7w4w) | |
7W4T
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![BU of 7w4t by Molmil](/molmil-images/mine/7w4t) | |
2W29
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![BU of 2w29 by Molmil](/molmil-images/mine/2w29) | Gly102Thr mutant of Rv3291c | Descriptor: | PROBABLE TRANSCRIPTIONAL REGULATORY PROTEIN | Authors: | Shrivastava, T, Dey, S, Ravishankar, R. | Deposit date: | 2008-10-25 | Release date: | 2009-11-17 | Last modified: | 2023-12-13 | Method: | X-RAY DIFFRACTION (4.1 Å) | Cite: | Ligand-Induced Structural Transitions, Mutational Analysis, and 'Open' Quaternary Structure of the M. Tuberculosis Feast/Famine Regulatory Protein (Rv3291C). J.Mol.Biol., 392, 2009
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7W4S
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![BU of 7w4s by Molmil](/molmil-images/mine/7w4s) | |
7W4U
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![BU of 7w4u by Molmil](/molmil-images/mine/7w4u) | |
7W4V
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![BU of 7w4v by Molmil](/molmil-images/mine/7w4v) | |
6AVK
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![BU of 6avk by Molmil](/molmil-images/mine/6avk) | Streptavidin bound to peptide-like compound KPM-6 | Descriptor: | 1-hydroxydodecan-4-one, N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({[(2H-1,3-benzodioxol-5-yl)methyl][2-(chloromethyl)-1,3-oxazole-4-carbonyl]amino}methyl)-N-[(4-carbamoyl-1,3-oxazol-2-yl)methyl]-1,3-oxazole-4-carboxamide, Streptavidin | Authors: | Park, H, Shamim, R, McEnaney, P, Kodadek, T. | Deposit date: | 2017-09-02 | Release date: | 2018-08-08 | Last modified: | 2023-10-04 | Method: | X-RAY DIFFRACTION (1.4 Å) | Cite: | Efficient Workflow for Screening DNA-encoded One Bead One Compound Libraries Using a Flow Cytometer To be Published
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6SAI
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![BU of 6sai by Molmil](/molmil-images/mine/6sai) | |
8I60
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![BU of 8i60 by Molmil](/molmil-images/mine/8i60) | |