8A4M

Crystal structure of the VIM-2 acquired metallo-beta-Lactamase in complex with compound 8 (JMV-7061)

Summary for 8A4M

• Entry DOI: 10.2210/pdb8a4m/pdb
• Descriptor: Metallo-beta-lactamase VIM-2-like protein, ZINC ION, ACETATE ION, ... (5 entities in total)
• Functional Keywords: metallo-beta-lactamase, vim-2, triazole-thione, inhibitor, zinc, hydrolase
• Biological source: Pseudomonas aeruginosa
• Total number of polymer chains: 1
• Total formula weight: 26306.17

Authors

Tassone, G.,Benvenuti, M.,Verdirosa, F.,Corsica, G.,Sannio, F.,Docquier, J.D.,Pozzi, C.,Mangani, S. (deposition date: 2022-06-13, release date: 2023-04-26, Last modification date: 2024-02-07)

• Primary citation: Legru, A.,Verdirosa, F.,Vo-Hoang, Y.,Tassone, G.,Vascon, F.,Thomas, C.A.,Sannio, F.,Corsica, G.,Benvenuti, M.,Feller, G.,Coulon, R.,Marcoccia, F.,Devente, S.R.,Bouajila, E.,Piveteau, C.,Leroux, F.,Deprez-Poulain, R.,Deprez, B.,Licznar-Fajardo, P.,Crowder, M.W.,Cendron, L.,Pozzi, C.,Mangani, S.,Docquier, J.D.,Hernandez, J.F.,Gavara, L.; Optimization of 1,2,4-Triazole-3-thiones toward Broad-Spectrum Metallo-beta-lactamase Inhibitors Showing Potent Synergistic Activity on VIM- and NDM-1-Producing Clinical Isolates.; J.Med.Chem., 65:16392-16419, 2022; PubMed: 36450011; DOI: 10.1021/acs.jmedchem.2c01257

Experimental method

X-RAY DIFFRACTION (1.98 Å)