Ligand · XX2

XX2 · 1-keto,2-hydroxy,4-nitrobenzene, 1 electron oxidized

XX2, 1-keto,2-hydroxy,4-nitrobenzene, 1 electron oxidized (C6 H4 N O4, 154.1 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…

Component: XX2
Formula: C6 H4 N O4
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

XX2 in 2 structures; the first of them:

2IGA · Structure of Homoprotocatechuate 2,3-Dioxygenase from B. fuscum in complex with reactive… · XX2 C601 · 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… · XX2 C601 · 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

XX3 · (1S)-1-hydroperoxy-1-hydroxy-2-keto-5-nitrocyclohexa-3,5-diene
XXP · 2-keto,5-nitro,6-hydroxy-3,5-hexadienoic acid
CA · Calcium ion
FE2 · Fe (II) ion
CL · Chloride ion
OXY · Oxygen molecule
GOL · Glycerol

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