6UEL

CPS1 bound to allosteric inhibitor H3B-193

6UEL の概要

• エントリーDOI: 10.2210/pdb6uel/pdb
• 分子名称: Carbamoyl-phosphate synthase [ammonia], mitochondrial, ZINC ION, N~1~-[(4-fluorophenyl)methyl]-N~1~-methyl-N~4~-(4-methyl-1,3-thiazol-2-yl)piperidine-1,4-dicarboxamide, ... (4 entities in total)
• 機能のキーワード: allosteric inhibitor, cps1, ligase, transferase, ligase-ligase inhibitor complex, ligase/ligase inhibitor
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 331168.83

構造登録者

Larsen, N.A.,Nguyen, T.V. (登録日: 2019-09-21, 公開日: 2020-03-18, 最終更新日: 2023-10-11)

• 主引用文献: Yao, S.,Nguyen, T.V.,Rolfe, A.,Agrawal, A.A.,Ke, J.,Peng, S.,Colombo, F.,Yu, S.,Bouchard, P.,Wu, J.,Huang, K.C.,Bao, X.,Omoto, K.,Selvaraj, A.,Yu, L.,Ioannidis, S.,Vaillancourt, F.H.,Zhu, P.,Larsen, N.A.,Bolduc, D.M.; Small Molecule Inhibition of CPS1 Activity through an Allosteric Pocket.; Cell Chem Biol, 27:259-268.e5, 2020; PubMed: 32017919; DOI: 10.1016/j.chembiol.2020.01.009

実験手法

X-RAY DIFFRACTION (1.9 Å)