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Ligand · XXP

XXP · 2-keto,5-nitro,6-hydroxy-3,5-hexadienoic acid

XXP, 2-keto,5-nitro,6-hydroxy-3,5-hexadienoic acid (C6 H5 N O6, 187.1 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 most and the…

Component
XXP
Formula
C6 H5 N O6
Class
ligand
Structures
2
PDB entries
1

Binding sites

XXP in 2 structures; the first of them:

  • 2IGA · Structure of Homoprotocatechuate 2,3-Dioxygenase from B. fuscum in complex with reactive… · XXP A600 · binds HIS155, ASN157, TRP192, HIS200, HIS214, ARG243, HIS248, GLY249 and 8 more
  • 2IGA · Structure of homoprotocatechuate 2,3-dioxygenase from B. fuscum in complex with reactive… · XXP A600 · binds HIS155, ASN157, TRP192, HIS200, HIS214, ARG243, HIS248, GLY249 and 8 more

Residues it binds most

HIS 2, ARG 2, TRP 2, TYR 2, ASN 2, GLU 2, GLY 2, SER 2, VAL 2 (residue and the binding sites it lines).

Found with

  • XX2 · 1-keto,2-hydroxy,4-nitrobenzene, 1 electron oxidized
  • XX3 · (1S)-1-hydroperoxy-1-hydroxy-2-keto-5-nitrocyclohexa-3,5-diene
  • CA · Calcium ion
  • FE2 · Fe (II) ion
  • CL · Chloride ion
  • OXY · Oxygen molecule
  • GOL · Glycerol

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