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Ligand · VUA

VUA · 4-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyrimidin-2-amine

VUA, 4-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyrimidin-2-amine (C18 H24 N4, 296.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
VUA
Formula
C18 H24 N4
Class
ligand
Structures
2
PDB entries
1

Binding sites

VUA in 2 structures; the first of them:

  • 7K41 · Bacterial O-GlcNAcase (OGA) with compound · VUA A2602 · binds GLY135, PHE136, TYR137, ASP242, CYS278, TYR282, TRP286, THR310 and 9 more
  • 7K41 · Bacterial O-glcnacase (oga) with compound · VUA A2602 · binds GLY135, TYR137, ASP242, CYS278, TYR282, THR310, VAL314, ILE315 and 6 more

Residues it binds most

TYR 2, ASN 2, ASP 2, TRP 2, VAL 2, CYS 2, GLY 2, HIS 2, ILE 2, THR 2 (residue and the binding sites it lines).

Found with

  • ACT · Acetate ion
  • EDO · 1,2-ethanediol

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