5EE8

Crystal structure of S02030 boronic acid inhibitor complexed to SHV-1 beta-lactamase

Summary for 5EE8

• Entry DOI: 10.2210/pdb5ee8/pdb
• Related: 5EEC
• Descriptor: Beta-lactamase SHV-1, 1-{(2R)-2-(dihydroxyboranyl)-2-[(thiophen-2-ylacetyl)amino]ethyl}-1H-1,2,3-triazole-4-carboxylic acid, CYCLOHEXYL-HEXYL-BETA-D-MALTOSIDE, ... (4 entities in total)
• Functional Keywords: transition state inhibitor, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• Biological source: Klebsiella pneumoniae
• Total number of polymer chains: 1
• Total formula weight: 30248.34

Authors

Krishnan, N.,van den Akker, F. (deposition date: 2015-10-22, release date: 2016-01-27, Last modification date: 2023-09-27)

• Primary citation: Nguyen, N.Q.,Krishnan, N.P.,Rojas, L.J.,Prati, F.,Caselli, E.,Romagnoli, C.,Bonomo, R.A.,van den Akker, F.; Crystal Structures of KPC-2 and SHV-1 beta-Lactamases in Complex with the Boronic Acid Transition State Analog S02030.; Antimicrob.Agents Chemother., 60:1760-1766, 2016; PubMed: 26729491; DOI: 10.1128/AAC.02643-15

Experimental method

X-RAY DIFFRACTION (1.54 Å)