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4FPT	Carbonic Anhydrase II in complex with ethyl (2Z,4R)-2-(sulfamoylimino)-1,3-thiazolidine-4-carboxylate Descriptor: Carbonic anhydrase 2, DIMETHYL SULFOXIDE, GLYCEROL, ... Authors: Di Pizio, A, Heine, A, Klebe, G. Deposit date: 2012-06-22 Release date: 2013-07-03 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (0.98 Å) Cite: High resolution crystal structures of Carbonic Anhydrase II in complex with novel sulfamide binders To be Published
4FIK	Human carbonic anhydrase II H64A complexed with thioxolone hydrolysis products Descriptor: 2,4-dihydroxybenzenesulfenic acid, 4,4'-disulfanediyldibenzene-1,3-diol, 4-MERCAPTOBENZENE-1,3-DIOL, ... Authors: Sippel, K.H, Genis, C, Govindasamy, L, Agbandje-McKenna, M, Tripp, B.C, McKenna, R. Deposit date: 2012-06-08 Release date: 2012-06-27 Last modified: 2023-11-29 Method: X-RAY DIFFRACTION (1.2 Å) Cite: Synchrotron Radiation Provides a Plausible Explanation for the Generation of a Free Radical Adduct of Thioxolone in Mutant Carbonic Anhydrase II. J Phys Chem Lett, 1, 2010
2H15	Carbonic anhydrase inhibitors: Clashing with Ala65 as a means of designing isozyme-selective inhibitors that show low affinity for the ubiquitous isozyme II Descriptor: Carbonic anhydrase 2, MERCURY (II) ION, N-{[(3AS,5AR,8AR,8BS)-2,2,7,7-TETRAMETHYLTETRAHYDRO-3AH-BIS[1,3]DIOXOLO[4,5-B:4',5'-D]PYRAN-3A-YL]METHYL}SULFAMIDE, ... Authors: Winum, J.Y, Temperini, C, Ciattini, S, Scozzafava, A, Supuran, C.T. Deposit date: 2006-05-16 Release date: 2007-03-27 Last modified: 2024-02-14 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Carbonic anhydrase inhibitors: clash with Ala65 as a means for designing inhibitors with low affinity for the ubiquitous isozyme II, exemplified by the crystal structure of the topiramate sulfamide analogue. J.Med.Chem., 49, 2006
6NJ6	Thermostable variant of human carbonic anhydrase with tetrazine 2.0 at site 186 reacted with sTCO in crystallo Descriptor: Carbonic anhydrase 2, GLYCEROL, METHANOL, ... Authors: Kean, K.M, Karplus, P.A. Deposit date: 2019-01-02 Release date: 2019-10-02 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.6 Å) Cite: Immobilization of Proteins with Controlled Load and Orientation. ACS Appl Mater Interfaces, 11, 2019
6NJ5	Thermostable variant of human carbonic anhydrase II with disordered tetrazine 2.0 at site 233 Descriptor: Carbonic anhydrase 2, ZINC ION Authors: Kean, K.M, Karplus, P.A. Deposit date: 2019-01-02 Release date: 2019-10-02 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.25 Å) Cite: Immobilization of Proteins with Controlled Load and Orientation. ACS Appl Mater Interfaces, 11, 2019
6NJ2	thermostable carbonic anhydrase II variant with tetrazine 2.0 at site 186 Descriptor: Carbonic anhydrase 2, GLYCEROL, SULFATE ION, ... Authors: Kean, K.M, Karplus, P.A. Deposit date: 2019-01-02 Release date: 2019-10-02 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Immobilization of Proteins with Controlled Load and Orientation. ACS Appl Mater Interfaces, 11, 2019
6NJ4	Thermostable variant of human carbonic anhydrase with disordered tetrazine 2.0 reacted with strained trans-cyclooctene at site 233 Descriptor: Carbonic anhydrase 2, ZINC ION Authors: Kean, K.M, Karplus, P.A. Deposit date: 2019-01-02 Release date: 2019-10-02 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.3 Å) Cite: Immobilization of Proteins with Controlled Load and Orientation. ACS Appl Mater Interfaces, 11, 2019
6NJ3	Thermostable variant of human carbonic anhydrase with ordered tetrazine 2.0 at site 233 Descriptor: ACETATE ION, Carbonic anhydrase 2, ZINC ION Authors: Kean, K.M, Karplus, P.A. Deposit date: 2019-01-02 Release date: 2019-10-02 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.01 Å) Cite: Immobilization of Proteins with Controlled Load and Orientation. ACS Appl Mater Interfaces, 11, 2019
2NMX	Structure of inhibitor binding to Carbonic Anhydrase I Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Carbonic anhydrase 1, N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE, ... Authors: Christianson, D.W, Jude, K.M. Deposit date: 2006-10-23 Release date: 2007-04-24 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (1.55 Å) Cite: Structural Analysis of Charge Discrimination in the Binding of Inhibitors to Human Carbonic Anhydrases I and II J.Am.Chem.Soc., 129, 2007
2NNV	Structure of inhibitor binding to Carbonic Anhydrase II Descriptor: Carbonic anhydrase 2, ETHYL 3-[4-(AMINOSULFONYL)PHENYL]PROPANOATE, GLYCEROL, ... Authors: Christianson, D.W, Jude, K.M. Deposit date: 2006-10-24 Release date: 2007-05-08 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (1.1 Å) Cite: Structural Analysis of Charge Discrimination in the Binding of Inhibitors to Human Carbonic Anhydrases I and II. J.Am.Chem.Soc., 129, 2007
6OUK	Carbonic Anhydrase II complexed with benzene sulfonamide MB10-580B Descriptor: (2Z)-2-(hydroxyimino)-2,3-dihydro-1,3-benzoxazole-5-sulfonamide, Carbonic anhydrase 2, GLYCEROL, ... Authors: Kota, A, McKenna, R. Deposit date: 2019-05-04 Release date: 2020-05-06 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.498 Å) Cite: Carbonic Anhydrase II complexed with benzene sulfonamide MB10-580B To Be Published
2NN7	Structure of inhibitor binding to Carbonic Anhydrase I Descriptor: Carbonic anhydrase 1, DIMETHYL SULFOXIDE, ETHYL 3-[4-(AMINOSULFONYL)PHENYL]PROPANOATE, ... Authors: Christianson, D.W, Jude, K.M. Deposit date: 2006-10-23 Release date: 2007-05-08 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (1.85 Å) Cite: Structural Analysis of Charge Discrimination in the Binding of Inhibitors to Human Carbonic Anhydrases I and II. J.Am.Chem.Soc., 129, 2007
2NNG	Structure of inhibitor binding to Carbonic Anhydrase II Descriptor: 4-(2-AMINOETHYL)BENZENESULFONAMIDE, Carbonic anhydrase 2, GLYCEROL, ... Authors: Christianson, D.W, Jude, K.M. Deposit date: 2006-10-24 Release date: 2007-05-08 Last modified: 2023-12-27 Method: X-RAY DIFFRACTION (1.2 Å) Cite: Structural Analysis of Charge Discrimination in the Binding of Inhibitors to Human Carbonic Anhydrases I and II. J.Am.Chem.Soc., 129, 2007
2NNS	Structure of inhibitor binding to Carbonic Anhydrase II Descriptor: CHLORIDE ION, Carbonic anhydrase 2, GLYCEROL, ... Authors: Christianson, D.W, Jude, K.M. Deposit date: 2006-10-24 Release date: 2007-05-08 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (1.03 Å) Cite: Structural Analysis of Charge Discrimination in the Binding of Inhibitors to Human Carbonic Anhydrases I and II. J.Am.Chem.Soc., 129, 2007
2NN1	Structure of inhibitor binding to Carbonic Anhydrase I Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 3-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACID, Carbonic anhydrase 1, ... Authors: Christianson, D.W, Jude, K.M. Deposit date: 2006-10-23 Release date: 2007-04-24 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (1.65 Å) Cite: Structural Analysis of Charge Discrimination in the Binding of Inhibitors to Human Carbonic Anhydrases I and II J.Am.Chem.Soc., 129, 2007
2NNO	Structure of inhibitor binding to Carbonic Anhydrase II Descriptor: 3-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACID, Carbonic anhydrase 2, GLYCEROL, ... Authors: Christianson, D.W, Jude, K.M. Deposit date: 2006-10-24 Release date: 2007-05-08 Last modified: 2024-10-09 Method: X-RAY DIFFRACTION (1.01 Å) Cite: Structural Analysis of Charge Discrimination in the Binding of Inhibitors to Human Carbonic Anhydrases I and II. J.Am.Chem.Soc., 129, 2007
6OTK	Carbonic Anhydrase IX mimic complexed with ureido benzene sulfonamide MB10-596B Descriptor: 4-hydroxy-3-{[(4-hydroxybutyl)carbamoyl]amino}benzene-1-sulfonamide, Carbonic anhydrase 2, GLYCEROL, ... Authors: Kota, A, McKenna, R. Deposit date: 2019-05-03 Release date: 2020-05-06 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.123 Å) Cite: Carbonic Anhydrase IX mimic complexed with ureido benzene sulfonamide MB9-561B To Be Published
6OTQ	Carbonic Anhydrase II complexed with ureic benzene sulfonamide MB10-596B Descriptor: 4-hydroxy-3-{[(4-hydroxybutyl)carbamoyl]amino}benzene-1-sulfonamide, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ... Authors: Kota, A, McKenna, R. Deposit date: 2019-05-03 Release date: 2020-05-06 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.467 Å) Cite: Carbonic Anhydrase II complexed with benzene sulfonamide MB9-561B To Be Published
6OUH	Carbonic Anhydrase II mimic complexed with benzene sulfonamide MB11-710A Descriptor: 3-{[(4-hydroxybutyl)carbamoyl]amino}benzene-1-sulfonamide, Carbonic anhydrase 2, GLYCEROL, ... Authors: Kota, A, McKenna, R. Deposit date: 2019-05-04 Release date: 2020-05-06 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.449 Å) Cite: Carbonic Anhydrase II mimic complexed with benzene sulfonamide MB11-710A To Be Published
6OUD	Carbonic Anhydrase IX mimic complexed with benzene sulfonamide MB11-694B Descriptor: 4-{[(2-hydroxyethyl)carbamoyl]amino}benzene-1-sulfonamide, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ... Authors: Kota, A, McKenna, R. Deposit date: 2019-05-04 Release date: 2020-05-06 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.256 Å) Cite: Carbonic Anhydrase IX mimic complexed with benzene sulfonamide MB11-694B To Be Published
6OUF	Carbonic Anhydrase IX mimic complexed with benzene sulfonamide MB11-707A Descriptor: 4-{[(4-hydroxybutyl)carbamoyl]amino}benzene-1-sulfonamide, Carbonic anhydrase 2, GLYCEROL, ... Authors: Kota, A, McKenna, R. Deposit date: 2019-05-04 Release date: 2020-05-06 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.358 Å) Cite: Carbonic Anhydrase IX mimic complexed with ureido benzene sulfonamide MB9-561B To Be Published
6ODZ	Benzensulfonamides bearing spyrohydantoin moieties act as potent inhibitors of human carbonic anhydrases II and VII and show neuropathic pain attenuating effects Descriptor: 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-(4-sulfamoylphenyl)acetamide, Carbonic anhydrase 2, GLYCEROL, ... Authors: Peat, T.S. Deposit date: 2019-03-27 Release date: 2019-06-12 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.3 Å) Cite: Benzensulfonamides bearing spyrohydantoin moieties act as potent inhibitors of human carbonic anhydrases II and VII and show neuropathic pain attenuating effects. Eur.J.Med.Chem., 177, 2019
6OUB	Carbonic Anhydrase II complexed with benzene sulfonamide MB11-694B Descriptor: 4-{[(2-hydroxyethyl)carbamoyl]amino}benzene-1-sulfonamide, Carbonic anhydrase 2, GLYCEROL, ... Authors: Kota, A, McKenna, R. Deposit date: 2019-05-04 Release date: 2020-05-06 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.418 Å) Cite: Carbonic Anhydrase II complexed with ureido benzene sulfonamide MB11-694B To Be Published
6OUE	Carbonic Anhydrase II complexed with benzene sulfonamide MB11-707A Descriptor: 4-{[(4-hydroxybutyl)carbamoyl]amino}benzene-1-sulfonamide, Carbonic anhydrase 2, GLYCEROL, ... Authors: Kota, A, McKenna, R. Deposit date: 2019-05-04 Release date: 2020-05-06 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.415 Å) Cite: Carbonic Anhydrase II complexed with ureido benzene sulfonamide MB11-707A To Be Published
6OUJ	Carbonic Anhydrase II complexed with benzene sulfonamide MB11-689A Descriptor: 3-[(1S)-1-(4-nitrophenyl)ethyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-sulfonamide, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ... Authors: Kota, A, McKenna, R. Deposit date: 2019-05-04 Release date: 2020-05-06 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.466 Å) Cite: Carbonic Anhydrase II complexed with benzene sulfonamide MB11-689A To Be Published

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