7JOB

Carbonic Anhydrase IX Mimic Complexed with N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide

7JOB の概要

• エントリーDOI: 10.2210/pdb7job/pdb
• 分子名称: Carbonic anhydrase 2, ZINC ION, N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide, ... (5 entities in total)
• 機能のキーワード: carbonic anhydrase, ca inhibitor, structure guided drug design, carbonic anhydrase ii, carbonic anhydrase ix, caii, caix, sulfonamide, lyase, lyase-inhibitor complex, lyase/inhibitor
• 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: 29634.79

構造登録者

Andring, J.T.,McKenna, R. (登録日: 2020-08-06, 公開日: 2020-11-04, 最終更新日: 2023-10-18)

• 主引用文献: Andring, J.T.,Fouch, M.,Akocak, S.,Angeli, A.,Supuran, C.T.,Ilies, M.A.,McKenna, R.; Structural Basis of Nanomolar Inhibition of Tumor-Associated Carbonic Anhydrase IX: X-Ray Crystallographic and Inhibition Study of Lipophilic Inhibitors with Acetazolamide Backbone.; J.Med.Chem., 63:13064-13075, 2020; PubMed: 33085484; DOI: 10.1021/acs.jmedchem.0c01390

実験手法

X-RAY DIFFRACTION (1.381 Å)