5ZJ2

Crystal structure of NDM-1 in complex with D-captopril

Summary for 5ZJ2

• Entry DOI: 10.2210/pdb5zj2/pdb
• Related: 5ZIO 5ZJ1
• Descriptor: Metallo-beta-lactamase type 2, ZINC ION, 1-(3-MERCAPTO-2-METHYL-PROPIONYL)-PYRROLIDINE-2-CARBOXYLIC ACID, ... (4 entities in total)
• Functional Keywords: ndm-1, metallo-beta-lactamase, antibiotic resistent, inhibitor, thio compounds, hydrolase
• Biological source: Klebsiella pneumoniae
• Total number of polymer chains: 1
• Total formula weight: 25979.92

Authors

Zhang, H.,Hao, Q. (deposition date: 2018-03-18, release date: 2019-03-20, Last modification date: 2023-11-22)

• Primary citation: Ma, G.,Wang, S.,Wu, K.,Zhang, W.,Ahmad, A.,Hao, Q.,Lei, X.,Zhang, H.; Structure-guided optimization of D-captopril for discovery of potent NDM-1 inhibitors; Bioorg.Med.Chem., 29:-, 2020; DOI: 10.1016/j.bmc.2020.115902

Experimental method

X-RAY DIFFRACTION (1.1 Å)