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Ligand · XM8

XM8 · 7-[(1~{S})-1-[[4-(aminomethyl)phenyl]methoxy]ethyl]-3-[3-chloranyl-4-(methylsulfonylmethyl)phenyl]-1~{H}-indole-2-carboxylic acid

XM8, 7-[(1~{S})-1-[[4-(aminomethyl)phenyl]methoxy]ethyl]-3-[3-chloranyl-4-(methylsulfonylmethyl)phenyl]-1~{H}-indole-2-carboxylic acid (C27 H27 Cl N2 O5 S, 527.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB…

Component
XM8
Formula
C27 H27 Cl N2 O5 S
Class
ligand
Structures
2
PDB entries
2

Binding sites

XM8 in 2 structures; the first of them:

  • 8PAH · Crystal structure of the metallo-beta-lactamase VIM1 with 2596 · XM8 A303 · binds PHE62, TYR67, TRP87, HIS116, ASP117, ASP118, GLU146, HIS179 and 8 more
  • 8PAL · Crystal structure of the metallo-beta-lactamase VIM1 with 2651 · XM8 A303 · binds PHE62, TYR67, TRP87, HIS116, ASP117, ASP118, GLU146, HIS179 and 11 more

Residues it binds most

HIS 2, ASP 2, ALA 2, ASN 2, CYS 2, GLU 2, GLY 2, PHE 2, SER 1, TRP 2 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion

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