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Ligand · XB4

XB4 · 3-(2-ethoxy-5-fluoranyl-pyridin-3-yl)-7-propan-2-yl-1~{H}-indole-2-carboxylic acid

XB4, 3-(2-ethoxy-5-fluoranyl-pyridin-3-yl)-7-propan-2-yl-1~{H}-indole-2-carboxylic acid (C19 H19 F N2 O3, 342.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5…

Component
XB4
Formula
C19 H19 F N2 O3
Class
ligand
Structures
1
PDB entries
1

Binding sites

XB4 in 1 structure; the first of them:

  • 8P9P · Crystal structure of the metallo-beta-lactamase VIM1 with 2408 · XB4 A303 · binds PHE62, TYR67, TRP87, HIS116, ASP117, ASP118, HIS179, CYS198 and 5 more

Residues it binds most

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

Found with

  • ZN · Zinc ion

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