6SBL
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![BU of 6sbl by Molmil](/molmil-images/mine/6sbl) | Human Carbonic Anhydrase II in complex with 4-hexylbenzenesulfonamide | 分子名称: | (4-CARBOXYPHENYL)(CHLORO)MERCURY, 4-hexylbenzenesulfonamide, CITRATE ANION, ... | 著者 | Gloeckner, S, Ngo, K, Heine, A, Klebe, G. | 登録日 | 2019-07-21 | 公開日 | 2020-08-26 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (0.94 Å) | 主引用文献 | Human Carbonic Anhydrase II in complex with 4-hexylbenzenesulfonamide To Be Published
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6SDI
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![BU of 6sdi by Molmil](/molmil-images/mine/6sdi) | Human Carbonic Anhydrase II in complex with an inhibitor soaked at a concentration of 0.01 mM | 分子名称: | (4-CARBOXYPHENYL)(CHLORO)MERCURY, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ... | 著者 | Gloeckner, S, Haake, M, Heine, A, Klebe, G. | 登録日 | 2019-07-27 | 公開日 | 2020-08-26 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.03 Å) | 主引用文献 | Human Carbonic Anhydrase II in complex with an inhibitor soaked at a concentration of 0.01 mM To Be Published
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6SEY
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![BU of 6sey by Molmil](/molmil-images/mine/6sey) | Human Carbonic Anhydrase II in complex with aliphatically substituted benzenesulfonamide | 分子名称: | (4-CARBOXYPHENYL)(CHLORO)MERCURY, 4-(4-oxidanylbutyl)benzenesulfonamide, Carbonic anhydrase 2, ... | 著者 | Gloeckner, S, Ngo, K, Heine, A, Klebe, G. | 登録日 | 2019-07-30 | 公開日 | 2020-08-26 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.23 Å) | 主引用文献 | Human Carbonic Anhydrase II in complex with aliphatically substituted benzenesulfonamide To Be Published
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6SFQ
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![BU of 6sfq by Molmil](/molmil-images/mine/6sfq) | Atomic resolution structure of human Carbonic Anhydrase II in complex with (R)-5-phenyloxazolidine-2,4-dione | 分子名称: | (4-CARBOXYPHENYL)(CHLORO)MERCURY, (5R)-5-phenyl-1,3-oxazolidine-2,4-dione, Carbonic anhydrase 2, ... | 著者 | Gloeckner, S, Ngo, K, Heine, A, Klebe, G. | 登録日 | 2019-08-02 | 公開日 | 2020-08-26 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1 Å) | 主引用文献 | Atomic resolution structure of human Carbonic Anhydrase II in complex with (R)-5-phenyloxazolidine-2,4-dione To Be Published
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6SDL
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![BU of 6sdl by Molmil](/molmil-images/mine/6sdl) | Human Carbonic Anhydrase II in complex with (R)-N-(3-(1H-indol-1-yl)-2-methylpropyl)-4-sulfamoylbenzamide | 分子名称: | (4-CARBOXYPHENYL)(CHLORO)MERCURY, (R)-N-(3-INDOL-1-YL-2-METHYL-PROPYL)-4-SULFAMOYL-BENZAMIDE, Carbonic anhydrase 2, ... | 著者 | Gloeckner, S, Gerber, H.D, Heine, A, Klebe, G. | 登録日 | 2019-07-28 | 公開日 | 2020-08-26 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.08 Å) | 主引用文献 | Human Carbonic Anhydrase II in complex with (R)-N-(3-(1H-indol-1-yl)-2-methylpropyl)-4-sulfamoylbenzamide To Be Published
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6SG6
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![BU of 6sg6 by Molmil](/molmil-images/mine/6sg6) | |
6SG0
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![BU of 6sg0 by Molmil](/molmil-images/mine/6sg0) | |
6RVL
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![BU of 6rvl by Molmil](/molmil-images/mine/6rvl) | Crystal structure of hCA II with Urea, N-(1,3-dihydro-1-hydroxy-2,1-benzoxaborol-6-yl)-?N'-phenyl- | 分子名称: | 1-[1,1-bis(oxidanyl)-3~{H}-2,1-benzoxaborol-1-ium-6-yl]-3-phenyl-thiourea, Carbonic anhydrase 2, ZINC ION | 著者 | Di Fiore, A, De Simone, G. | 登録日 | 2019-05-31 | 公開日 | 2019-08-28 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.72 Å) | 主引用文献 | Exploring benzoxaborole derivatives as carbonic anhydrase inhibitors: a structural and computational analysis reveals their conformational variability as a tool to increase enzyme selectivity. J Enzyme Inhib Med Chem, 34, 2019
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6RVK
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![BU of 6rvk by Molmil](/molmil-images/mine/6rvk) | Crystal structure of hCA II in complex with Urea, N-(1,3-dihydro-1-hydroxy-2,1-benzoxaborol-6-yl)-N'-(phenylmethyl)- | 分子名称: | 1-[7,7-bis(oxidanyl)-8-oxa-7-boranuidabicyclo[4.3.0]nona-1,3,5-trien-4-yl]-3-(phenylmethyl)urea, Carbonic anhydrase 2, ZINC ION | 著者 | Di Fiore, A, De Simone, G. | 登録日 | 2019-05-31 | 公開日 | 2019-08-28 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.58 Å) | 主引用文献 | Exploring benzoxaborole derivatives as carbonic anhydrase inhibitors: a structural and computational analysis reveals their conformational variability as a tool to increase enzyme selectivity. J Enzyme Inhib Med Chem, 34, 2019
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6RQN
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![BU of 6rqn by Molmil](/molmil-images/mine/6rqn) | |
6RQU
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![BU of 6rqu by Molmil](/molmil-images/mine/6rqu) | |
3OU9
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![BU of 3ou9 by Molmil](/molmil-images/mine/3ou9) | |
6SYS
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![BU of 6sys by Molmil](/molmil-images/mine/6sys) | Crystal structure of (3aR,4S,9bS)-4-(4-hydroxyphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide with carbonic anhydrase 2 | 分子名称: | (4~{S})-4-(4-hydroxyphenyl)-2,3,4,5-tetrahydro-1~{H}-cyclopenta[c]quinoline-8-sulfonamide, GLYCEROL, ZINC ION, ... | 著者 | Angeli, A, Ferraroni, M. | 登録日 | 2019-10-01 | 公開日 | 2020-10-14 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.3 Å) | 主引用文献 | Crystal structure of (3aR,4S,9bS)-4-(4-hydroxyphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide with carbonic anhydrase 2 To Be Published
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3TIS
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![BU of 3tis by Molmil](/molmil-images/mine/3tis) | Crystal structures of yrdA from Escherichia coli, a homologous protein of gamma-class carbonic anhydrases, show possible allosteric conformations | 分子名称: | Protein YrdA, ZINC ION | 著者 | Park, H.M, Chio, J.W, Lee, J.E, Jung, J.H, Kim, B.Y, Kim, J.S. | 登録日 | 2011-08-21 | 公開日 | 2012-08-01 | 最終更新日 | 2024-03-20 | 実験手法 | X-RAY DIFFRACTION (2.3 Å) | 主引用文献 | Structures of the gamma-class carbonic anhydrase homologue YrdA suggest a possible allosteric switch Acta Crystallogr.,Sect.D, 68, 2012
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3LAS
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![BU of 3las by Molmil](/molmil-images/mine/3las) | Crystal structure of carbonic anhydrase from streptococcus mutans to 1.4 angstrom resolution | 分子名称: | GLYCEROL, GUANIDINE, MAGNESIUM ION, ... | 著者 | Ma, L.-L, Wang, K.-T, Liu, X, Su, X.-D. | 登録日 | 2010-01-07 | 公開日 | 2011-01-12 | 最終更新日 | 2024-03-20 | 実験手法 | X-RAY DIFFRACTION (1.4 Å) | 主引用文献 | Crystal structure of carbonic anhydrase from streptococcus mutans to 1.4 angstrom resolution To be published
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3TIO
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![BU of 3tio by Molmil](/molmil-images/mine/3tio) | Crystal structures of yrdA from Escherichia coli, a homologous protein of gamma-class carbonic anhydrase, show possible allosteric conformations | 分子名称: | PHOSPHATE ION, Protein YrdA, ZINC ION | 著者 | Park, H.M, Choi, J.W, Lee, J.E, Jung, C.H, Kim, B.Y, Kim, J.S. | 登録日 | 2011-08-21 | 公開日 | 2012-08-01 | 最終更新日 | 2023-11-01 | 実験手法 | X-RAY DIFFRACTION (1.41 Å) | 主引用文献 | Structures of the gamma-class carbonic anhydrase homologue YrdA suggest a possible allosteric switch Acta Crystallogr.,Sect.D, 68, 2012
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3M2Z
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![BU of 3m2z by Molmil](/molmil-images/mine/3m2z) | |
2MFZ
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![BU of 2mfz by Molmil](/molmil-images/mine/2mfz) | NMR structure of C-terminal domain from A. ventricosus minor ampullate spidroin (MiSp) | 分子名称: | Minor ampullate spidroin | 著者 | Otikovs, M, Jaudzems, K, Andersson, M, Chen, G, Landreh, M, Nordling, K, Kronqvist, N, Westermark, P, Jornvall, H, Knight, S, Ridderstrale, Y, Holm, L, Meng, Q, Chesler, M, Johansson, J, Rising, A. | 登録日 | 2013-10-24 | 公開日 | 2014-08-20 | 最終更新日 | 2024-05-01 | 実験手法 | SOLUTION NMR | 主引用文献 | Carbonic Anhydrase Generates CO2 and H+ That Drive Spider Silk Formation Via Opposite Effects on the Terminal Domains Plos Biol., 12, 2014
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6C7W
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![BU of 6c7w by Molmil](/molmil-images/mine/6c7w) | Carbonic anhydrase 2 in complex with [(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXYTETRAHYDRO-2-FURANYL]METHYL SULFAMATE inhibitor | 分子名称: | Carbonic anhydrase 2, SODIUM ION, ZINC ION, ... | 著者 | Peat, T.S, Mujumdar, P, Poulsen, S.A. | 登録日 | 2018-01-23 | 公開日 | 2018-05-23 | 最終更新日 | 2023-10-04 | 実験手法 | X-RAY DIFFRACTION (1.28 Å) | 主引用文献 | Synthesis, structure and bioactivity of primary sulfamate-containing natural products. Bioorg. Med. Chem. Lett., 28, 2018
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4FU5
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![BU of 4fu5 by Molmil](/molmil-images/mine/4fu5) | |
1IF9
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![BU of 1if9 by Molmil](/molmil-images/mine/1if9) | Carbonic Anhydrase II Complexed With N-[2-(1H-Indol-5-yl)-butyl]-4-sulfamoyl-benzamide | 分子名称: | CARBONIC ANHYDRASE II, MERCURY (II) ION, N-[2-(1H-INDOL-5-YL)-BUTYL]-4-SULFAMOYL-BENZAMIDE, ... | 著者 | Grzybowski, B.A, Ishchenko, A.V, Kim, C.-Y, Topalov, G, Chapman, R, Christianson, D.W, Whitesides, G.M, Shakhnovich, E.I. | 登録日 | 2001-04-12 | 公開日 | 2001-05-02 | 最終更新日 | 2023-08-16 | 実験手法 | X-RAY DIFFRACTION (2 Å) | 主引用文献 | Combinatorial computational method gives new picomolar ligands for a known enzyme. Proc.Natl.Acad.Sci.USA, 99, 2002
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8XEG
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![BU of 8xeg by Molmil](/molmil-images/mine/8xeg) | |
8C0R
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![BU of 8c0r by Molmil](/molmil-images/mine/8c0r) | Crystal structure of human carbonic anhydrase II in complex with a coumarin derivative. | 分子名称: | Carbonic anhydrase 2, ZINC ION, bis(fluoranyl)-(4-methyl-2-oxidanylidene-chromen-7-yl)methanesulfonamide | 著者 | Alterio, V, De Simone, G, Esposito, D. | 登録日 | 2022-12-19 | 公開日 | 2023-03-08 | 最終更新日 | 2024-02-14 | 実験手法 | X-RAY DIFFRACTION (1.56 Å) | 主引用文献 | A Combined in Silico and Structural Study Opens New Perspectives on Aliphatic Sulfonamides, a Still Poorly Investigated Class of CA Inhibitors. Biology (Basel), 12, 2023
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8Q0C
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![BU of 8q0c by Molmil](/molmil-images/mine/8q0c) | Human carbonic anhydrase II containing 3-fluorotyrosine | 分子名称: | Carbonic anhydrase 2, MERCURIBENZOIC ACID, ZINC ION | 著者 | Pham, L.B.T, Costantino, A, Barbieri, L, Calderone, V, Luchinat, E, Banci, L. | 登録日 | 2023-07-28 | 公開日 | 2024-03-06 | 実験手法 | X-RAY DIFFRACTION (1.3 Å) | 主引用文献 | Controlling the incorporation of fluorinated amino acids in human cells and its structural impact. Protein Sci., 33, 2024
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8PHL
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![BU of 8phl by Molmil](/molmil-images/mine/8phl) | Human carbonic anhydrase II containing 4-fluorophenylalanine | 分子名称: | Carbonic anhydrase 2, MERCURIBENZOIC ACID, ZINC ION | 著者 | Pham, L.B.T, Costantino, A, Barbieri, L, Calderone, V, Luchinat, E, Banci, L. | 登録日 | 2023-06-20 | 公開日 | 2024-03-06 | 実験手法 | X-RAY DIFFRACTION (1.3 Å) | 主引用文献 | Controlling the incorporation of fluorinated amino acids in human cells and its structural impact. Protein Sci., 33, 2024
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