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3OKU	Human Carbonic Anhydrase II in complex with 2-Ethylestrone-3-O-sulfamate Descriptor: (9beta)-2-ethyl-17-oxoestra-1(10),2,4-trien-3-yl sulfamate, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ... Authors: Sippel, K.H, Stander, B.A, Robbins, A.H, Tu, C.K, Agbandje-McKenna, M, Silverman, D.N, Joubert, A.M, McKenna, R. Deposit date: 2010-08-25 Release date: 2011-07-06 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (1.45 Å) Cite: Characterization of Carbonic Anhydrase Isozyme Specific Inhibition by Sulfamated 2-Ethylestra Compounds LETT.DRUG DES.DISCOVERY, 8, 2011
3OIM	Human Carbonic anhydrase II bound by 2-Ethylestradiol 3-O-sulfamate Descriptor: (14beta,17alpha)-2-ethyl-17-hydroxyestra-1(10),2,4-trien-3-yl sulfamate, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ... Authors: Sippel, K.H, Stander, B.A, Robbins, A.H, Tu, C.K, Agbandje-McKenna, M, Silverman, D.N, Joubert, A.M, McKenna, R. Deposit date: 2010-08-19 Release date: 2011-07-06 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (1.45 Å) Cite: Characterization of Carbonic Anhydrase Isozyme Specific Inhibition by Sulfamated 2-Ethylestra Compounds LETT.DRUG DES.DISCOVERY, 8, 2011
2Q1Q	Carbonic anhydrase inhibitors. Interaction of the antiepileptic drug sulthiame with twelve mammalian isoforms: kinetic and X-Ray crystallographic studies Descriptor: Carbonic anhydrase 2, MERCURY (II) ION, SULTHIAME, ... Authors: Temperini, C, Innocenti, A, Mastrolorenzo, A, Scozzafava, A, Supuran, C.T. Deposit date: 2007-05-25 Release date: 2007-09-11 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Carbonic anhydrase inhibitors. Interaction of the antiepileptic drug sulthiame with twelve mammalian isoforms: Kinetic and X-ray crystallographic studies. Bioorg.Med.Chem.Lett., 17, 2007
6LV9	Cu- Carbonic Anhydrase II pH 7.8 0 atm CO2 Descriptor: COPPER (II) ION, Carbonic anhydrase 2, GLYCEROL Authors: Kim, C.U, Kim, J.K. Deposit date: 2020-02-02 Release date: 2020-08-19 Last modified: 2023-11-29 Method: X-RAY DIFFRACTION (1.2 Å) Cite: Elucidating the role of metal ions in carbonic anhydrase catalysis. Nat Commun, 11, 2020
3R17	hCarbonic anhydrase II bound to N-(2-fluoro.4-sulfamoylphenyl)-2-(thiophen-2-yl) acetamide Descriptor: Carbonic anhydrase 2, DIMETHYL SULFOXIDE, GLYCEROL, ... Authors: Biswas, S, McKenna, R. Deposit date: 2011-03-09 Release date: 2011-05-25 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Conformational variability of different sulfonamide inhibitors with thienyl-acetamido moieties attributes to differential binding in the active site of cytosolic human carbonic anhydrase isoforms. Bioorg.Med.Chem., 19, 2011
2POW	The crystal structure of the human carbonic anhydrase II in complex with 4-amino-6-trifluoromethyl-benzene-1,3-disulfonamide Descriptor: 4-AMINO-6-(TRIFLUOROMETHYL)BENZENE-1,3-DISULFONAMIDE, Carbonic anhydrase 2, ZINC ION Authors: Alterio, V, De Simone, G. Deposit date: 2007-04-27 Release date: 2007-07-24 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (1.75 Å) Cite: Carbonic anhydrase inhibitors: Inhibition of human, bacterial, and archaeal isozymes with benzene-1,3-disulfonamides-Solution and crystallographic studies. Bioorg.Med.Chem.Lett., 17, 2007
3RG3	Crystal structure of the W5E mutant of human carbonic anhydrase II Descriptor: Carbonic anhydrase 2, ZINC ION Authors: Domsic, J.F, Robbins, A.H, McKenna, R. Deposit date: 2011-04-07 Release date: 2012-02-22 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.903 Å) Cite: Structure and catalysis by carbonic anhydrase II: role of active-site tryptophan 5. Arch.Biochem.Biophys., 516, 2011
3Q31	Structure of fungal alpha Carbonic Anhydrase from Aspergillus oryzae Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Carbonic anhydrase, D-MALATE, ... Authors: Cuesta-Seijo, J.A, Borchert, M.S, Navarro-Poulsen, J.C, Schnorr, K.M, Leggio, L.L. Deposit date: 2010-12-21 Release date: 2011-03-09 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (2.703 Å) Cite: Structure of fungal alpha Carbonic Anhydrase from Aspergillus oryzae To be Published
3RLD	Crystal structure of the Y7I mutant of human carbonic anhydrase II Descriptor: Carbonic anhydrase 2, SULFATE ION, ZINC ION Authors: Avvaru, B.S, Mikulski, R, McKenna, R. Deposit date: 2011-04-19 Release date: 2012-02-08 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Kinetic and crystallographic studies of the role of tyrosine 7 in the active site of human carbonic anhydrase II. Arch.Biochem.Biophys., 506, 2011
2QO8	Crystal structure of the complex of hcaii with an indane-sulfonamide inhibitor Descriptor: Carbonic anhydrase 2, GLYCEROL, MERCURIBENZOIC ACID, ... Authors: D'Ambrosio, K, De Simone, G. Deposit date: 2007-07-20 Release date: 2008-01-22 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (1.4 Å) Cite: Carbonic Anhydrase Inhibitors: Binding of Indanesulfonamides to the Human Isoform II. Chemmedchem, 3, 2007
3RG4	Crystal structure of the W5F mutant of human carbonic anhydrase II Descriptor: Carbonic anhydrase 2, ZINC ION Authors: Domsic, J.F, Robbins, A.H, McKenna, R. Deposit date: 2011-04-07 Release date: 2012-02-22 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Structure and catalysis by carbonic anhydrase II: role of active-site tryptophan 5. Arch.Biochem.Biophys., 516, 2011
2OSF	Inhibition of Carbonic Anhydrase II by Thioxolone: A Mechanistic and Structural Study Descriptor: 4-MERCAPTOBENZENE-1,3-DIOL, Carbonic anhydrase 2, S-(2,4-dihydroxyphenyl) hydrogen thiocarbonate, ... Authors: Albert, A.B, Caroli, G, Govindasamy, L, Agbandje-McKenna, M, McKenna, R, Tripp, B.C. Deposit date: 2007-02-05 Release date: 2008-05-27 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (1.6 Å) Cite: Inhibition of carbonic anhydrase II by thioxolone: a mechanistic and structural study. Biochemistry, 47, 2008
5JMZ	Carbonic Anhydrase IX-mimic IN Complex WITH U-NO2 Descriptor: 4-{[(3-nitrophenyl)carbamoyl]amino}benzenesulfonamide, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ... Authors: McKenna, R, Mboge, M.Y, Mahon, B.P. Deposit date: 2016-04-29 Release date: 2017-05-03 Last modified: 2024-03-06 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Carbonic Anhydrase IX-mimic IN Complex WITH U-NO2 To Be Published
5JNA	Crystal structure for the complex of human carbonic anhydrase IV and topiramate Descriptor: ACETATE ION, Carbonic anhydrase 4, GLYCEROL, ... Authors: Chen, Z, Waheed, A, Di Cera, E, Sly, W.S. Deposit date: 2016-04-29 Release date: 2017-05-03 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (2 Å) Cite: Intrinsic thermodynamics of high affinity inhibitor binding to recombinant human carbonic anhydrase IV. Eur. Biophys. J., 47, 2018
6NLV	Selective inhibition of carbonic anhydrase IX activity, using compound SLC-149, displays limited anticancer effects in breast cancer cell lines Descriptor: 4-[3-(2,4-difluorophenyl)-2-oxo-2,3-dihydro-1H-imidazol-1-yl]benzene-1-sulfonamide, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ... Authors: Singh, S, McKenna, R. Deposit date: 2019-01-09 Release date: 2020-01-15 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.794 Å) Cite: Inhibition of Carbonic Anhydrase Using SLC-149: Support for a Noncatalytic Function of CAIX in Breast Cancer. J.Med.Chem., 64, 2021
1CVD	STRUCTURAL CONSEQUENCES OF REDESIGNING A PROTEIN-ZINC BINDING SITE Descriptor: CARBONIC ANHYDRASE II, ZINC ION Authors: Ippolito, J.A, Christianson, D.W. Deposit date: 1994-06-21 Release date: 1994-12-20 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Structural consequences of redesigning a protein-zinc binding site. Biochemistry, 33, 1994
1CVH	STRUCTURAL CONSEQUENCES OF REDESIGNING A PROTEIN-ZINC BINDING SITE Descriptor: CARBONIC ANHYDRASE II, ZINC ION Authors: Ippolito, J.A, Christianson, D.W. Deposit date: 1994-11-16 Release date: 1995-02-07 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Structural consequences of redesigning a protein-zinc binding site. Biochemistry, 33, 1994
6T4O	Human Carbonic anhydrase II bound by 3,5-dimethylbenzenesulfonamide Descriptor: 3,5-dimethylbenzenesulfonamide, BICINE, DIMETHYL SULFOXIDE, ... Authors: Smirnov, A, Manakova, E, Grazulis, S. Deposit date: 2019-10-14 Release date: 2020-10-14 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.133 Å) Cite: Isoform-Selective Enzyme Inhibitors by Exploring Pocket Size According to the Lock-and-Key Principle. Biophys.J., 119, 2020
6T7U	Carborane inhibitor of Carbonic Anhydrase IX Descriptor: Carbonic anhydrase 2, Carborane inhibitor, ZINC ION Authors: Brynda, J, Rezacova, P, Kugler, M, Gruner, B. Deposit date: 2019-10-23 Release date: 2020-06-17 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.2 Å) Cite: Sulfonamido carboranes as highly selective inhibitors of cancer-specific carbonic anhydrase IX. Eur.J.Med.Chem., 200, 2020
6T81	Human Carbonic anhydrase II bound by 2-Naphthalenesulfonamide. Descriptor: AZIDE ION, BICINE, SODIUM ION, ... Authors: Smirnov, A, Manakova, E, Grazulis, S. Deposit date: 2019-10-23 Release date: 2020-10-14 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (0.98 Å) Cite: Isoform-Selective Enzyme Inhibitors by Exploring Pocket Size According to the Lock-and-Key Principle. Biophys.J., 119, 2020
1CNW	SECONDARY INTERACTIONS SIGNIFICANTLY REMOVED FROM THE SULFONAMIDE BINDING POCKET OF CARBONIC ANHYDRASE II INFLUENCE BINDING CONSTANTS Descriptor: AMINOMETHYLENECARBONYLAMINODI(ETHYLOXY)ETHYLAMINOCARBONYLBENZENESULFONAMIDE, CARBONIC ANHYDRASE II, MERCURY (II) ION, ... Authors: Boriack, P.A, Christianson, D.W. Deposit date: 1995-07-21 Release date: 1995-11-14 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (2 Å) Cite: Secondary interactions significantly removed from the sulfonamide binding pocket of carbonic anhydrase II influence inhibitor binding constants. J.Med.Chem., 38, 1995
6T9Z	Nidocarborane inhibitor of Carbonic Anhydrase IX Descriptor: Carbonic anhydrase 2, DIMETHYL SULFOXIDE, Nidocarborane, ... Authors: Brynda, J, Rezacova, P, Kugler, M, Gruner, B. Deposit date: 2019-10-29 Release date: 2020-06-17 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.12 Å) Cite: Sulfonamido carboranes as highly selective inhibitors of cancer-specific carbonic anhydrase IX. Eur.J.Med.Chem., 200, 2020
1CNB	COMPENSATORY PLASTIC EFFECTS IN THE REDESIGN OF PROTEIN-ZINC BINDING SITES Descriptor: BETA-MERCAPTOETHANOL, CARBONIC ANHYDRASE II Authors: Ippolito, J.A, Christianson, D.W. Deposit date: 1994-06-13 Release date: 1994-10-15 Last modified: 2017-11-29 Method: X-RAY DIFFRACTION (2.35 Å) Cite: Structural consequences of redesigning a protein-zinc binding site. Biochemistry, 33, 1994
6T4N	Human Carbonic anhydrase II bound by 2,4,6-trimethylbenzenesulfonamide Descriptor: 2,4,6-trimethylbenzenesulfonamide, 2-piperazin-1-ylethanol, BICINE, ... Authors: Smirnov, A, Manakova, E, Grazulis, S. Deposit date: 2019-10-14 Release date: 2020-10-14 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.4 Å) Cite: Isoform-Selective Enzyme Inhibitors by Exploring Pocket Size According to the Lock-and-Key Principle. Biophys.J., 119, 2020
1CVE	STRUCTURAL CONSEQUENCES OF REDESIGNING A PROTEIN-ZINC BINDING SITE Descriptor: CARBONIC ANHYDRASE II, ZINC ION Authors: Ippolito, J.A, Christianson, D.W. Deposit date: 1994-06-21 Release date: 1994-11-30 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (2.25 Å) Cite: Structural consequences of redesigning a protein-zinc binding site. Biochemistry, 33, 1994

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