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Ligand · WDX

WDX · [4-(2-hydroxyethyl)piperidin-1-yl](5-methyl-1H-indol-2-yl)methanone

WDX, [4-(2-hydroxyethyl)piperidin-1-yl](5-methyl-1H-indol-2-yl)methanone (C17 H22 N2 O2, 286.4 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…

Component
WDX
Formula
C17 H22 N2 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

WDX in 2 structures; the first of them:

  • 4WDX · 17beta-HSD5 in complex with [4-(2-hydroxyethyl)piperidin-1-yl](5-methyl-1H-indol-2-yl)meth… · WDX A402 · binds TYR24, LEU54, TYR55, TRP86, HIS117, SER118, MET120, ASN167 and 7 more
  • 4WDX · 17BETA-HSD5 in complex with [4-(2-HYDROXYETHYL)PIPERIDIN-1-YL](5… · WDX A402 · binds TYR24, LEU54, TYR55, TRP86, HIS117, SER118, MET120, ASN167 and 7 more

Residues it binds most

SER 4, PHE 4, TRP 4, TYR 4, ASN 4, GLN 4, HIS 4, LEU 4, MET 4, ARG 2 (residue and the binding sites it lines).

Found with

  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate

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