6TGI

Crystal structure of VIM-2 in complex with triazole-based inhibitor OP24

Summary for 6TGI

• Entry DOI: 10.2210/pdb6tgi/pdb
• Descriptor: Vim-1, ZINC ION, FORMIC ACID, ... (5 entities in total)
• Functional Keywords: new delhi metallo-beta-lactamase, hydrolase
• Biological source: Pseudomonas aeruginosa
• Total number of polymer chains: 2
• Total formula weight: 53560.15

Authors

Maso, L.,Spirakis, F.,Santucci, M.,Simon, C.,Docquier, J.D.,Cruciani, G.,Costi, M.P.,Tondi, D.,Cendron, L. (deposition date: 2019-11-15, release date: 2020-10-14, Last modification date: 2024-01-24)

• Primary citation: Spyrakis, F.,Santucci, M.,Maso, L.,Cross, S.,Gianquinto, E.,Sannio, F.,Verdirosa, F.,De Luca, F.,Docquier, J.D.,Cendron, L.,Tondi, D.,Venturelli, A.,Cruciani, G.,Costi, M.P.; Virtual screening identifies broad-spectrum beta-lactamase inhibitors with activity on clinically relevant serine- and metallo-carbapenemases.; Sci Rep, 10:12763-12763, 2020; PubMed: 32728062; DOI: 10.1038/s41598-020-69431-y

Experimental method

X-RAY DIFFRACTION (1.6 Å)