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Ligand · XNE

XNE · 7-[(1~{S})-1-[4-(aminomethyl)phenyl]carbonyloxyethyl]-3-[6-(morpholin-4-ylmethyl)pyridin-3-yl]-1~{H}-indole-2-carboxylic acid

XNE, 7-[(1~{S})-1-[4-(aminomethyl)phenyl]carbonyloxyethyl]-3-[6-(morpholin-4-ylmethyl)pyridin-3-yl]-1~{H}-indole-2-carboxylic acid (C29 H30 N4 O5, 514.6 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every…

Component
XNE
Formula
C29 H30 N4 O5
Class
ligand
Structures
1
PDB entries
1

Binding sites

XNE in 1 structure; the first of them:

  • 8PAC · Crystal structure of the metallo-beta-lactamase VIM1 with 2553 · XNE A303 · binds PHE62, TYR67, TRP87, HIS116, ASP117, ASP118, GLU146, HIS179 and 8 more

Residues it binds most

HIS 1, ASP 1, ALA 1, ASN 1, CYS 1, GLU 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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