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Ligand · IWA

IWA · (2R)-2-azanyl-5-[[2-[3-methyl-2,6-bis(oxidanylidene)-7-(phenylmethyl)purin-8-yl]sulfanyl-3H-benzimidazol-5-yl]amino]-5-oxidanylidene-pentanoic acid

IWA, (2R)-2-azanyl-5-[[2-[3-methyl-2,6-bis(oxidanylidene)-7-(phenylmethyl)purin-8-yl]sulfanyl-3H-benzimidazol-5-yl]amino]-5-oxidanylidene-pentanoic acid (C25 H24 N8 O5 S, 548.6 g/mol), in the MolNFT structures on GenesisL1: bound in 1…

Component
IWA
Formula
C25 H24 N8 O5 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

IWA in 1 structure; the first of them:

  • 7ZIF · Crystal structure of human tryptophan hydroxylase 1 in complex with inhibitor KM-480 · IWA A502 · binds VAL232, GLY234, TYR235, LEU236, SER237, PRO238, PHE241, THR253 and 15 more

Residues it binds most

PHE 1, SER 1, TYR 1, GLY 1, HIS 1, PRO 1, THR 1, ALA 1, ARG 1, GLU 1 (residue and the binding sites it lines).

Found with

  • FE · Fe (III) ion
  • GOL · Glycerol

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