6DPY

X-ray crystal structure of AmpC beta-lactamase with inhibitor

Summary for 6DPY

• Entry DOI: 10.2210/pdb6dpy/pdb
• Descriptor: Beta-lactamase, 4-{[(4R)-6-fluoro-3,4-dihydro-2H-1-benzopyran-4-yl]sulfamoyl}-2,5-dimethylfuran-3-carboxylic acid (3 entities in total)
• Functional Keywords: ampc beta-lacatamase, inhibitor complex, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• Biological source: Escherichia coli (strain K12)
• Total number of polymer chains: 2
• Total formula weight: 79914.57

Authors

Singh, I. (deposition date: 2018-06-09, release date: 2018-07-04, Last modification date: 2023-10-11)

• Primary citation: Lyu, J.,Wang, S.,Balius, T.E.,Singh, I.,Levit, A.,Moroz, Y.S.,O'Meara, M.J.,Che, T.,Algaa, E.,Tolmachova, K.,Tolmachev, A.A.,Shoichet, B.K.,Roth, B.L.,Irwin, J.J.; Ultra-large library docking for discovering new chemotypes.; Nature, 566:224-229, 2019; PubMed: 30728502; DOI: 10.1038/s41586-019-0917-9

Experimental method

X-RAY DIFFRACTION (1.91 Å)