9D54

Crystal structure of KPC-2 complexed with compound 12

This is a non-PDB format compatible entry.

Summary for 9D54

• Entry DOI: 10.2210/pdb9d54/pdb
• Related: 9D2U
• Descriptor: Carbapenem-hydrolyzing beta-lactamase KPC, [(7-cyclopropyl-6-fluoro-1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)methyl]phosphonic acid, SULFATE ION, ... (4 entities in total)
• Functional Keywords: inhibitor, beta-lactamase, complex, kpc, hydrolase, hydrolase-inhibitor complex, hydrolase/inhibitor
• Biological source: Klebsiella pneumoniae
• Total number of polymer chains: 1
• Total formula weight: 31502.13

Authors

Jacobs, L.M.C.,Chen, Y. (deposition date: 2024-08-13, release date: 2025-10-29)

• Primary citation: Jacobs, L.M.C.,Chen, Y.,Renslo, A.; Hit to Lead Optimization of Heteroaryl Phosphonates Reversible, Broad-Spectrum Inhibitors of Serine and Metallo Carbapenemases.; To Be Published,

Experimental method

X-RAY DIFFRACTION (1.6 Å)