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Ligand · VVS

VVS · 2,6-bis(1H-imidazol-1-ylmethyl)-4-(2,4,4-trimethylpentan-2-yl)phenol

VVS, 2,6-bis(1H-imidazol-1-ylmethyl)-4-(2,4,4-trimethylpentan-2-yl)phenol (C22 H30 N4 O, 366.5 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…

Component
VVS
Formula
C22 H30 N4 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

VVS in 2 structures; the first of them:

  • 4UMX · IDH1 R132H in complex with cpd 1 · VVS A1415 · binds LEU120, TRP124, ILE130, MET254, VAL255, ALA258, PHE265, TRP267 and 6 more
  • 4UMX · IDH1 R132H in complex with cpd 1 · VVS A1415 · binds LEU120, TRP124, ILE130, MET254, VAL255, ALA258, PHE265, TRP267 and 6 more

Residues it binds most

ALA 2, MET 2, TRP 2, VAL 2, ASP 2, ILE 2, LEU 2, PHE 2, SER 2, TYR 2 (residue and the binding sites it lines).

Found with

  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate
  • GOL · Glycerol

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