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PDB: 387 results

3P5A
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BU of 3p5a by Molmil
Human Carbonic Anhydrase complexed with Sodium morpholinocarbodithioate
Descriptor: Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ZINC ION, ...
Authors:Aggarwal, M, McKenna, R.
Deposit date:2010-10-08
Release date:2011-10-19
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.49 Å)
Cite:Dithiocarbamates strongly inhibit carbonic anhydrases and show antiglaucoma action in vivo
J.Med.Chem., 55, 2012
3P5L
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BU of 3p5l by Molmil
Human Carbonic Anhydrase complexed with sodium 4-cyano-4-phenylpiperidine-1-carbodithioate
Descriptor: 4-cyano-4-phenylpiperidine-1-carbodithioic acid, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ...
Authors:Aggarwal, M, McKenna, R.
Deposit date:2010-10-08
Release date:2011-10-19
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.498 Å)
Cite:Dithiocarbamates: a new class of carbonic anhydrase inhibitors. Crystallographic and kinetic investigations.
Chem.Commun.(Camb.), 48, 2012
3N2P
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BU of 3n2p by Molmil
Crystal structure of human carbonic anhydrase II in complex with a benzenesulfonamide inhibitor
Descriptor: 4-{[(3-nitrophenyl)carbamoyl]amino}benzenesulfonamide, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ...
Authors:Avvaru, B.S, Wagner, J, Robbins, A.H, McKenna, R.
Deposit date:2010-05-18
Release date:2011-03-09
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.648 Å)
Cite:Selective hydrophobic pocket binding observed within the carbonic anhydrase II active site accommodate different 4-substituted-ureido-benzenesulfonamides and correlate to inhibitor potency.
Chem.Commun.(Camb.), 46, 2010
3MZC
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BU of 3mzc by Molmil
Human carbonic ahydrase II in complex with a benzenesulfonamide inhibitor
Descriptor: 4-[(cyclopentylcarbamoyl)amino]benzenesulfonamide, Carbonic anhydrase 2, GLYCEROL, ...
Authors:Avvaru, B.S, Wagner, J, Robbins, A.H, Mckenna, R.
Deposit date:2010-05-12
Release date:2011-03-09
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.498 Å)
Cite:Selective hydrophobic pocket binding observed within the carbonic anhydrase II active site accommodate different 4-substituted-ureido-benzenesulfonamides and correlate to inhibitor potency.
Chem.Commun.(Camb.), 46, 2010
3N3J
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BU of 3n3j by Molmil
Crystal structure of human carbonic anhydrase II in complex with a benzenesulfonamide inhibitor
Descriptor: 4-({[2-(1-methylethyl)phenyl]carbamoyl}amino)benzenesulfonamide, Carbonic anhydrase 2, GLYCEROL, ...
Authors:Avvaru, B.S, Wagner, J, Robbins, A.H, McKenna, R.
Deposit date:2010-05-20
Release date:2011-03-09
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Selective hydrophobic pocket binding observed within the carbonic anhydrase II active site accommodate different 4-substituted-ureido-benzenesulfonamides and correlate to inhibitor potency.
Chem.Commun.(Camb.), 46, 2010
3OY0
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BU of 3oy0 by Molmil
Human Carbonic Anhydrase II complexed with 1-(4-(4-(2-(ISOPROPYLSULFONYL)PHENYLAMINO)-1H-PYRROLO[2,3-B]PYRIDIN-6-YLAMINO)-3-METHOXYPHENYL)PIPERIDIN-4-OL
Descriptor: (2S)-2-tert-butyl-N-(4-sulfamoylphenyl)pentanamide, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ...
Authors:Aggarwal, M, McKenna, R.
Deposit date:2010-09-22
Release date:2011-08-10
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Anticonvulsant 4-aminobenzenesulfonamide derivatives with branched-alkylamide moieties: X-ray crystallography and inhibition studies of human carbonic anhydrase isoforms I, II, VII, and XIV.
J.Med.Chem., 54, 2011
3N4B
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BU of 3n4b by Molmil
Crystal structure of human carbonic anhydrase II in complex with a benzenesulfonamide inhibitor
Descriptor: 4-{[(4-fluorophenyl)carbamoyl]amino}benzenesulfonamide, Carbonic anhydrase 2, GLYCEROL, ...
Authors:Avvaru, B.S, Wagner, J, Robbins, A.H, McKenna, R.
Deposit date:2010-05-21
Release date:2011-03-09
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Selective hydrophobic pocket binding observed within the carbonic anhydrase II active site accommodate different 4-substituted-ureido-benzenesulfonamides and correlate to inhibitor potency.
Chem.Commun.(Camb.), 46, 2010
3OTM
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BU of 3otm by Molmil
Crystal structures of wild-type gamma-carbonic anhydrase from Methanosarcina thermophila
Descriptor: Carbonic anhydrase, ZINC ION
Authors:Domsic, J.F, Robbins, A.H, McKenna, R.
Deposit date:2010-09-13
Release date:2011-10-26
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Crystal structures of gamma-carbonic anhydrase mutants from Methanosarcina thermophila
To be Published
3OUP
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BU of 3oup by Molmil
Crystal structure of the gamma-carbonic anhydrase W19N mutant from Methanosarcina thermophila
Descriptor: Carbonic anhydrase, ZINC ION
Authors:Domsic, J.F, Robbins, A.H, McKenna, R.
Deposit date:2010-09-15
Release date:2011-10-26
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Crystal structure of the gamma-carbonic anhydrase W19N mutant from Methanosarcina thermophila
To be Published
3OYS
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BU of 3oys by Molmil
Human Carbonic Anhydrase II complexed with 2-{[4-AMINO-3-(3-HYDROXYPROP-1-YN-1-YL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-1-YL]METHYL}-5-METHYL-3-(2-METHYLPHENYL)QUINAZOLIN-4(3H)-ONE
Descriptor: 2-phenyl-N-(4-sulfamoylphenyl)acetamide, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ...
Authors:Aggarwal, M, McKenna, R.
Deposit date:2010-09-23
Release date:2011-08-10
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.538 Å)
Cite:Anticonvulsant 4-aminobenzenesulfonamide derivatives with branched-alkylamide moieties: X-ray crystallography and inhibition studies of human carbonic anhydrase isoforms I, II, VII, and XIV.
J.Med.Chem., 54, 2011
3OW5
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BU of 3ow5 by Molmil
Crystal structure of the Y200A mutant of gamma carbonic anhydrase from Methanosarcina thermophila
Descriptor: BICARBONATE ION, Carbonic anhydrase, FE (III) ION, ...
Authors:Domsic, J.F, Robbins, A.H, McKenna, R.
Deposit date:2010-09-17
Release date:2011-10-26
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.801 Å)
Cite:Crystal structure of the Y200A mutant of Methanosarcina thermophila
TO BE PUBLISHED
3OU9
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BU of 3ou9 by Molmil
Crystal structure of gamma-carbonic anhydrase W19F mutant from Methanosarcina thermophila
Descriptor: BICARBONATE ION, Carbonic anhydrase, ZINC ION
Authors:Domsic, J.F, Robbins, A.H, McKenna, R.
Deposit date:2010-09-14
Release date:2011-10-26
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure of gamma-carbonic anhydrase W19F mutant from Methanosarcina thermophila
TO BE PUBLISHED

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