6H29

HUMAN CARBONIC ANHYDRASE II IN COMPLEX WITH BENZYL CARBAMATE

6H29 の概要

• エントリーDOI: 10.2210/pdb6h29/pdb
• 分子名称: Carbonic anhydrase 2, ZINC ION, (phenylmethyl) carbamate, ... (4 entities in total)
• 機能のキーワード: benzyl carbamate, inhibitor complex, human carbonic anhydrase ii, lyase
• 由来する生物種: Homo sapiens
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 29505.63

構造登録者

Alterio, V.,De Simone, G. (登録日: 2018-07-13, 公開日: 2018-09-05, 最終更新日: 2024-01-17)

主引用文献

De Simone, G.,Angeli, A.,Bozdag, M.,Supuran, C.T.,Winum, J.Y.,Monti, S.M.,Alterio, V.
Inhibition of carbonic anhydrases by a substrate analog: benzyl carbamate directly coordinates the catalytic zinc ion mimicking bicarbonate binding.
Chem. Commun. (Camb.), 54:10312-10315, 2018

PubMed Abstract: N-Unsubstituted carbamates have scarcely been investigated so far as carbonic anhydrase inhibitors (CAIs). By means of kinetic and structural studies, in this paper we demonstrate that such molecules can effectively inhibit hCAs and can be used as lead compounds for the development of CAIs possessing a binding mode similar to one of the CA substrates, bicarbonate.

PubMed: 30140816
DOI: 10.1039/c8cc05755a

実験手法

X-RAY DIFFRACTION (1.46 Å)