4DE0
CTX-M-9 class A beta-lactamase complexed with compound 16
Summary for 4DE0
Entry DOI | 10.2210/pdb4de0/pdb |
Related | 3G2Y 3G2Z 3G30 3G31 3G32 3G35 4DDS 4DDY 4DE0 4DE1 4DE3 |
Descriptor | Beta-lactamase, N-[3-(1H-tetrazol-5-yl)phenyl]-1H-benzimidazole-7-carboxamide, DIMETHYL SULFOXIDE, ... (4 entities in total) |
Functional Keywords | ctx-m, hydrolase/hydrolase inhibitor, molecular docking, fragment, hydrolase-hydrolase inhibitor complex |
Biological source | Escherichia coli |
Total number of polymer chains | 2 |
Total formula weight | 56599.65 |
Authors | Nichols, D.N.,Chen, Y. (deposition date: 2012-01-19, release date: 2012-03-28, Last modification date: 2023-09-13) |
Primary citation | Nichols, D.A.,Jaishankar, P.,Larson, W.,Smith, E.,Liu, G.,Beyrouthy, R.,Bonnet, R.,Renslo, A.R.,Chen, Y. Structure-Based Design of Potent and Ligand-Efficient Inhibitors of CTX-M Class A Beta-Lactamase J.Med.Chem., 55:2163-2172, 2012 Cited by PubMed: 22296601DOI: 10.1021/jm2014138 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.12 Å) |
Structure validation
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