9DTJ

Crystal structure of KPC-2 complexed with compound 13

This is a non-PDB format compatible entry.

Summary for 9DTJ

• Entry DOI: 10.2210/pdb9dtj/pdb
• Related: 9D2U 9D54 9D5Q 9D5R 9D8T 9D9N 9DAG 9DB7 9DE3 9DEW
• Descriptor: Carbapenem-hydrolyzing beta-lactamase KPC, {[6-fluoro-1-methyl-2-oxo-7-(pyrrolidin-1-yl)-1,2-dihydroquinolin-4-yl]methyl}phosphonic acid, SULFATE ION, ... (4 entities in total)
• Functional Keywords: inhibitor, beta-lactamase, complex, kpc, hydrolase
• Biological source: Klebsiella pneumoniae
• Total number of polymer chains: 1
• Total formula weight: 31339.04

Authors

Jacobs, L.M.C.,Chen, Y. (deposition date: 2024-10-01, release date: 2025-10-22)

• 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 (1.77 Å)