4ZWZ

Engineered Carbonic Anhydrase IX mimic in complex with a glucosyl sulfamate inhibitor

4ZWZ の概要

• エントリーDOI: 10.2210/pdb4zwz/pdb
• 関連するPDBエントリー: 4ZWX 4ZWY 4ZX0 4ZX1
• 分子名称: Carbonic anhydrase 2, ZINC ION, methyl (2S,4R)-1-[(2S,3R,4R,5S,6S)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]sulfonyl-4-sulfamoyloxy-pyrrolidine-2-carbox ylate, ... (5 entities in total)
• 機能のキーワード: carbonic anhydrase ix mimic, glucosyl sulfamate, inhibitor complex., lyase-lyase inhibitor complex, lyase/lyase inhibitor
• 由来する生物種: Homo sapiens (Human)
• 細胞内の位置: Cytoplasm : P00918
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 29516.58

構造登録者

Mahon, B.P.,Lomelino, C.L.,Driscoll, J.M.,McKenna, R. (登録日: 2015-05-19, 公開日: 2015-08-05, 最終更新日: 2023-09-27)

• 主引用文献: Mahon, B.P.,Lomelino, C.L.,Ladwig, J.,Rankin, G.M.,Driscoll, J.M.,Salguero, A.L.,Pinard, M.A.,Vullo, D.,Supuran, C.T.,Poulsen, S.A.,McKenna, R.; Mapping Selective Inhibition of the Cancer-Related Carbonic Anhydrase IX Using Structure-Activity Relationships of Glucosyl-Based Sulfamates.; J.Med.Chem., 58:6630-6638, 2015; PubMed: 26203869; DOI: 10.1021/acs.jmedchem.5b00845

実験手法

X-RAY DIFFRACTION (1.62 Å)