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Ligand · WLQ

WLQ · (2R,3R,4R,5S)-2-(hydroxymethyl)-1-{[4-({[(5P)-3-methyl-5-(pyridazin-3-yl)phenyl]amino}methyl)phenyl]methyl}piperidine-3,4,5-triol

WLQ, (2R,3R,4R,5S)-2-(hydroxymethyl)-1-{[4-({[(5P)-3-methyl-5-(pyridazin-3-yl)phenyl]amino}methyl)phenyl]methyl}piperidine-3,4,5-triol (C25 H30 N4 O4, 450.5 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry).…

Component
WLQ
Formula
C25 H30 N4 O4
Class
ligand
Structures
1
PDB entries
1

Binding sites

WLQ in 1 structure; the first of them:

  • 8EKN · Co-crystal structure of Chaetomium glucosidase with compound 15 · WLQ A901 · binds PRO412, PHE417, ARG419, PHE421, TRP423, ASP424, LYS470, PRO472 and 9 more

Residues it binds most

PHE 3, TRP 2, PRO 3, ASP 2, ARG 3, GLU 3, LYS 3, TYR 3, GLY 2, GLN 1 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • SO4 · Sulfate ion
  • GOL · Glycerol

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