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Ligand · X5B

X5B · (2R,3R,4R,5S)-1-{2-[4-(2-{[(5M)-3-chloro-5-(pyridazin-3-yl)phenyl]amino}ethyl)phenyl]ethyl}-2-(hydroxymethyl)piperidine-3,4,5-triol

X5B, (2R,3R,4R,5S)-1-{2-[4-(2-{[(5M)-3-chloro-5-(pyridazin-3-yl)phenyl]amino}ethyl)phenyl]ethyl}-2-(hydroxymethyl)piperidine-3,4,5-triol (C26 H31 Cl N4 O4, 499.0 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB…

Component
X5B
Formula
C26 H31 Cl N4 O4
Class
ligand
Structures
1
PDB entries
1

Binding sites

X5B in 1 structure; the first of them:

  • 8ECW · Co-crystal structure of Chaetomium glucosidase with compound 11 · X5B A901 · binds PRO412, PHE416, PHE417, ARG419, PHE421, TRP423, ASP424, GLY584 and 9 more

Residues it binds most

PHE 2, TRP 2, ASP 2, ARG 2, PRO 2, GLU 2, GLY 2, THR 2, TYR 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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