タイトル | Functionalization of Fluorinated Benzenesulfonamides and Their Inhibitory Properties toward Carbonic Anhydrases |
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ジャーナル・号・ページ | Chemmedchem, Vol. 10, Page 662-687, Year 2015 |
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掲載日 | 2014年6月3日 (構造データの登録日) |
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著者 | Dudutiene, V. / Zubriene, A. / Smirnov, A. / Timm, D.D. / Smirnoviene, J. / Kazokaite, J. / Michailoviene, V. / Zaksauskas, A. / Manakova, E. / Grazulis, S. / Matulis, D. |
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リンク | Chemmedchem / PubMed:25758852 |
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手法 | X線回折 |
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解像度 | 1.3 - 1.95 Å |
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構造データ | PDB-4qiy: Crystal structure of human carbonic anhydrase isozyme II with inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.3 Å PDB-4qiz: Crystal structure of human carbonic anhydrase isozyme XIII with inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.55 Å PDB-4qj0: Crystal structure of catalytic domain of human carbonic anhydrase isozyme XII with inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.55 Å PDB-4qjm: Crystal structure of human carbonic anhydrase isozyme II with inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.75 Å PDB-4qjo: Crystal structure of catalytic domain of human carbonic anhydrase isozyme XII with inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.8 Å PDB-4qjp: Crystal structure of human carbonic anhydrase isozyme XIII with inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.62 Å PDB-4qjw: Crystal structure of catalytic domain of human carbonic anhydrase isozyme XII with inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.55 Å PDB-4qjx: Crystal structure of human carbonic anhydrase isozyme XIII with inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.95 Å PDB-4qtl: Crystal structure of human carbonic anhydrase isozyme II with inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.8 Å |
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化合物 | ChemComp-WWX: 2,3,6-trifluoro-5-{[(1R,2S)-2-hydroxy-1,2-diphenylethyl]amino}-4-[(2-hydroxyethyl)sulfonyl]benzenesulfonamide
ChemComp-V1F: 3-(benzylamino)-2,5,6-trifluoro-4-[(2-phenylethyl)sulfonyl]benzenesulfonamide
ChemComp-WWO: 3-(benzylamino)-2,5,6-trifluoro-4-[(2-hydroxyethyl)sulfonyl]benzenesulfonamide
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由来 | - homo sapiens (ヒト)
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キーワード | LYASE/LYASE INHIBITOR / drug design / carbonic anhydrase / benzenesulfonamide / metal-binding / LYASE-LYASE INHIBITOR complex |
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