ISDA: 9R8F

Deposition Date 2025-05-16

Release Date 2026-03-25

Last Version Date 2026-03-25

Entry Detail

PDB ID:

9R8F

Keywords:

HYDROLASE

Title:

CTX-M-14 complexes with 3D Boron Heterocycles synthetized via EnT Catalysis

Biological Source:

Source Organism(s):

Klebsiella pneumoniae (Taxon ID: 573)

Expression System(s):

Escherichia coli

Method Details:

Experimental Method:

X-RAY DIFFRACTION

Resolution:

1.40 Å

R-Value Free:

0.21

R-Value Work:

0.19

R-Value Observed:

0.19

Space Group:

P 32 2 1

Download Validation Report

Macromolecular Entities

Polymer Type:polypeptide(L)
Molecule:Beta-lactamase
Chain IDs:A
Chain Length:262
Number of Molecules:1
Biological Source:Klebsiella pneumoniae

Ligand Molecules

A1JDI

Primary Citation

Fused 3D boron heterocycles via EnT catalysis: synthesis, modification and validation as beta-lactamase inhibitors.

Kortman, H.M, Fang, H, Bastick, K.A.C, Volkel, C, Oberthur, D, Seeberger, P.H, Perbandt, M, Molloy, J.J.Show

Chem Sci 17 247 254 (2026)

PMID: 41221109 DOI: 10.1039/d5sc05518k

Primary Citation of related structures

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