Ligand · WQZ

WQZ · (3P)-3-(5,6-dihydro-1,4-dioxin-2-yl)-5-{[(3-{[(2R,3R,4R,5S)-3,4,5-trihydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl}phenyl)methyl]amino}benzonitrile

WQZ, (3P)-3-(5,6-dihydro-1,4-dioxin-2-yl)-5-{[(3-{[(2R,3R,4R,5S)-3,4,5-trihydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl}phenyl)methyl]amino}benzonitrile (C25 H29 N3 O6, 467.5 g/mol), in the MolNFT structures on GenesisL1: bound in 1…

Component: WQZ
Formula: C25 H29 N3 O6
Class: ligand
Structures: 1
PDB entries: 1

Binding sites

WQZ in 1 structure; the first of them:

8EPO · Co-crystal structure of Chaetomium glucosidase with compound 18 · WQZ A1002 · binds PRO412, PHE416, PHE417, PHE421, TRP423, ASP424, GLY584, ASP586 and 8 more

Residues it binds most

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

Found with

NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
SO4 · Sulfate ion
BTB · 2-[bis-(2-hydroxy-ethyl)-amino]-2-hydroxymethyl-propane-1,3-diol
GOL · Glycerol

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