5LCA

VIM-2 metallo-beta-lactamase in complex with 3-oxo-2-(3-(trifluoromethyl)phenyl)isoindoline-4-carboxylic acid (compound 17)

Summary for 5LCA

Entry DOI	10.2210/pdb5lca/pdb
Descriptor	Metallo-beta-lactamase VIM-2, ZINC ION, 3-oxidanylidene-2-[3-(trifluoromethyl)phenyl]-1~{H}-isoindole-4-carboxylic acid, ... (5 entities in total)
Functional Keywords	metallo-beta-lactamase, inhibitor, complex, antibiotic resistance, hydrolase
Biological source	Pseudomonas aeruginosa
Total number of polymer chains	1
Total formula weight	29265.38
Authors	Li, G.-B.,Brem, J.,McDonough, M.A.,Schofield, C.J. (deposition date: 2016-06-20, release date: 2017-02-15, Last modification date: 2024-01-10)
Primary citation	Li, G.B.,Abboud, M.I.,Brem, J.,Someya, H.,Lohans, C.T.,Yang, S.Y.,Spencer, J.,Wareham, D.W.,McDonough, M.A.,Schofield, C.J. NMR-filtered virtual screening leads to non-metal chelating metallo-beta-lactamase inhibitors. Chem Sci, 8:928-937, 2017 Cited by PubMed: 28451231 DOI: 10.1039/c6sc04524c PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.93 Å)

Structure validation