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Ligand · HPX

HPX · (2Z,4E)-2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid

HPX, (2Z,4E)-2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid (C12 H10 O4, 218.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most…

Component
HPX
Formula
C12 H10 O4
Class
ligand
Structures
4
PDB entries
2

Binding sites

HPX in 4 structures; the first of them:

  • 2DSA · Ternary complex of BphK, a bacterial GST · HPX A1225 · binds PRO7, GLY8, ALA9, HIS106, SER110, PHE113, TRP164, TYR167
  • 3LM4 · Crystal Structure of 2,3-Dihydroxy Biphenyl dioxygenase from Rhodococcus sp. (strain RHA1) · HPX A406 · binds ASN157, VAL182, ILE189, TRP192, MSE205, ARG206, MSE208, HIS249 and 8 more
  • 2DSA · Ternary complex of bphk, a bacterial GST · HPX A1225 · binds PRO7, GLY8, ALA9, HIS106, SER110, PHE113, TRP164, TYR167
  • 3LM4 · Crystal structure of 2,3-dihydroxy biphenyl dioxygenase from rhodococcus sp. (strain RHA1) · HPX A406 · binds ASN157, VAL182, ILE189, TRP192, MSE205, ARG206, MSE208, HIS249 and 8 more

Residues it binds most

TYR 16, ILE 8, MSE 8, GLY 16, HIS 16, PHE 16, TRP 16, ALA 8, ARG 8, ASN 8 (residue and the binding sites it lines).

Found with

  • GSH · Glutathione
  • PEO · Hydrogen peroxide
  • FE · Fe (III) ion

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