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Ligand · MRE

MRE · 2-(4-dimethylaminophenyl)diazenylbenzoic acid

MRE, 2-(4-dimethylaminophenyl)diazenylbenzoic acid (C15 H15 N3 O2, 269.3 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 and…

Component
MRE
Formula
C15 H15 N3 O2
Class
ligand
Structures
4
PDB entries
2

Binding sites

MRE in 4 structures; the first of them:

  • 2V9C · X-ray Crystallographic Structure of a Pseudomonas aeruginosa Azoreductase in Complex with… · MRE A1214 · binds ARG12, PHE100, GLY147, GLY148, VAL56, PHE60, TYR131, PHE173
  • 3KEG · X-ray Crystallographic Structure of a Y131F mutant of Pseudomonas Aeruginosa Azoreductase… · MRE A214 · binds ASN99, PHE100, GLY147, GLY148, HIS149, PHE151, ASN157, MET160 and 5 more
  • 2V9C · X-ray crystallographic structure of a pseudomonas aeruginosa azoreductase in complex with… · MRE A1214 · binds ARG12, PHE100, GLY147, GLY148, VAL56, PHE60, TYR131, PHE173
  • 3KEG · X-ray crystallographic structure of a Y131F mutant of pseudomonas aeruginosa azoreductase… · MRE A214 · binds ASN99, PHE100, GLY147, GLY148, HIS149, PHE151, ASN157, MET160 and 5 more

Residues it binds most

PHE 8, GLY 8, ASN 6, VAL 8, ARG 4, HIS 4, TYR 4, GLU 2, MET 2 (residue and the binding sites it lines).

Found with

  • FMN · Flavin mononucleotide
  • GOL · Glycerol

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