2MLM

Solution structure of sortase A from S. aureus in complex with benzo[d]isothiazol-3-one based inhibitor

2MLM の概要

• エントリーDOI: 10.2210/pdb2mlm/pdb
• NMR情報: BMRB: 19826
• 分子名称: Sortase family protein, N-{2-oxo-2-[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]dec-1-ylamino]ethyl}-2-sulfanylbenzamide (2 entities in total)
• 機能のキーワード: hydrolase/hydrolase inhibitor, hydrolase-hydrolase inhibitor complex
• 由来する生物種: Staphylococcus aureus
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 17169.53

構造登録者

Jaudzems, K.,Zhulenkovs, D.,Leonchiks, A. (登録日: 2014-03-03, 公開日: 2014-11-19, 最終更新日: 2018-06-27)

• 主引用文献: Zhulenkovs, D.,Rudevica, Z.,Jaudzems, K.,Turks, M.,Leonchiks, A.; Discovery and structure-activity relationship studies of irreversible benzisothiazolinone-based inhibitors against Staphylococcus aureus sortase A transpeptidase.; Bioorg.Med.Chem., 22:5988-6003, 2014; PubMed: 25282649; DOI: 10.1016/j.bmc.2014.09.011

実験手法

SOLUTION NMR