6VNU

X-ray Crystal Structure of Ruthenocenyl-7-Aminocephalosporanic Acid Covalent Acyl-Enzyme Complex with CTX-M-14 E166A Beta-Lactamase

Summary for 6VNU

Entry DOI	10.2210/pdb6vnu/pdb
Descriptor	Beta-lactamase, ruthenocene, [(1,2,3,4,5-eta)-1-(4-{[carboxy(4-carboxy-5-methylidene-5,6-dihydro-2H-1,3-thiazin-2-yl)methyl]amino}-4-oxobutanoyl)cyclopentadienyl][(1,2,3,4,5-eta)-cyclopentadienyl]ruthenium, ... (5 entities in total)
Functional Keywords	organometallic, ctx-m-14, hydrolase
Biological source	Escherichia coli
Total number of polymer chains	2
Total formula weight	57725.95
Authors	Lewandowski, E.M.,Jacobs, L.M.C.,Chen, Y. (deposition date: 2020-01-29, release date: 2020-04-01, Last modification date: 2023-10-11)
Primary citation	Lewandowski, E.M.,Szczupak, L.,Kowalczyk, A.,Mendoza, G.,Arruebo, M.,Jacobs, L.M.C.,Staczek, P.,Chen, Y.,Kowalski, K. Metallocenyl 7-ACA Conjugates: Antibacterial Activity Studies and Atomic-Resolution X-ray Crystal Structure with CTX-M beta-Lactamase. Chembiochem, 21:2187-2195, 2020 Cited by PubMed: 32182393 DOI: 10.1002/cbic.202000054 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.47 Å)

Structure validation