5A93

293K Joint X-ray Neutron with Cefotaxime: EXPLORING THE MECHANISM OF BETA-LACTAM RING PROTONATION IN THE CLASS A BETA-LACTAMASE ACYLATION MECHANISM USING NEUTRON AND X-RAY CRYSTALLOGRAPHY

Summary for 5A93

Entry DOI	10.2210/pdb5a93/pdb
Related	5A90 5A91 5A92
Descriptor	BETA-LACTAMASE CTX-M-97, CEFOTAXIME, C3' cleaved, open, bound form, SULFATE ION, ... (4 entities in total)
Functional Keywords	hydrolase, joint neutron x-ray, beta lactamase
Biological source	ESCHERICHIA COLI
Total number of polymer chains	1
Total formula weight	28995.50
Authors	Vandavasi, V.G.,Weiss, K.L.,Cooper, J.B.,Erskine, P.T.,Tomanicek, S.J.,Ostermann, A.,Schrader, T.E.,Ginell, S.L.,Coates, L. (deposition date: 2015-07-17, release date: 2015-12-16, Last modification date: 2024-01-10)
Primary citation	Vandavasi, V.G.,Weiss, K.L.,Cooper, J.B.,Erskine, P.T.,Tomanicek, S.J.,Ostermann, A.,Schrader, T.E.,Ginell, S.L.,Coates, L. Exploring the Mechanism of Beta-Lactam Ring Protonation in the Class a Beta-Lactamase Acylation Mechanism Using Neutron and X-Ray Crystallography. J.Med.Chem., 59:474-, 2016 Cited by PubMed: 26630115 DOI: 10.1021/ACS.JMEDCHEM.5B01215 PDB entries with the same primary citation
Experimental method	NEUTRON DIFFRACTION (2.2 Å) X-RAY DIFFRACTION (1.598 Å)

Structure validation