7CBG

Crystal structure of threonyl-tRNA synthetase (ThrRS) from Salmonella enterica in complex with an inhibitor

7CBG の概要

• エントリーDOI: 10.2210/pdb7cbg/pdb
• 分子名称: Threonine--tRNA ligase, (2S,3R)-N-[(E)-4-[6,7-bis(chloranyl)-4-oxidanylidene-quinazolin-3-yl]but-2-enyl]-2-(methylamino)-3-oxidanyl-butanamide, ZINC ION, ... (4 entities in total)
• 機能のキーワード: ligase-inhibitor complex, ligase/inhibitor
• 由来する生物種: Salmonella enterica subsp. enterica serovar Cubana str. 76814
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 96858.39

構造登録者

Guo, J.,Chen, B.,Zhou, H. (登録日: 2020-06-12, 公開日: 2020-10-07, 最終更新日: 2023-11-29)

• 主引用文献: Guo, J.,Chen, B.,Yu, Y.,Cheng, B.,Ju, Y.,Tang, J.,Cai, Z.,Gu, Q.,Xu, J.,Zhou, H.; Structure-guided optimization and mechanistic study of a class of quinazolinone-threonine hybrids as antibacterial ThrRS inhibitors.; Eur.J.Med.Chem., 207:112848-112848, 2020; PubMed: 32980741; DOI: 10.1016/j.ejmech.2020.112848

実験手法

X-RAY DIFFRACTION (2.5 Å)