3IGP

Structure of inhibitor binding to Carbonic Anhydrase II

3IGP の概要

• エントリーDOI: 10.2210/pdb3igp/pdb
• 分子名称: Carbonic anhydrase 2, ZINC ION, 6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonamide, ... (5 entities in total)
• 機能のキーワード: carbonic anhydrase inhibitors, isoquinolines, lyase, acetylation, cytoplasm, disease mutation, metal-binding, polymorphism, zinc
• 由来する生物種: Homo sapiens (human)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 30083.30

構造登録者

Gitto, R.,Agnello, S.,Brynda, J.,Mader, P.,Supuran, C.T.,Chimirri, A. (登録日: 2009-07-28, 公開日: 2010-03-09, 最終更新日: 2023-11-01)

• 主引用文献: Gitto, R.,Agnello, S.,Ferro, S.,De Luca, L.,Vullo, D.,Brynda, J.,Mader, P.,Supuran, C.T.,Chimirri, A.; Identification of 3,4-Dihydroisoquinoline-2(1H)-sulfonamides as Potent Carbonic Anhydrase Inhibitors: Synthesis, Biological Evaluation, and Enzyme-Ligand X-ray Studies.; J.Med.Chem., 2010; PubMed: 20170095; DOI: 10.1021/jm9014026

実験手法

X-RAY DIFFRACTION (1.65 Å)