Ligand name: N-[(2,3-dihydroxyphenyl)carbonyl]-O-[(2S)-2-{[(2,3-dihydroxyphenyl)carbonyl]amino}-3-({N-[(2,3-dihydroxyphenyl)carbonyl]-L-seryl}oxy)propanoyl]-D-serine
PDB ligand accession: MCJ
DrugBank: n/a
PubChem: 49867288
ChEMBL: n/a
InChI Key: NTWRWGRCGVKQNS-KSZLIROESA-N
SMILES: c1cc(c(c(c1)O)O)C(=O)NC(CO)C(=O)OCC(C(=O)OCC(C(=O)O)NC(=O)c2cccc(c2O)O)NC(=O)c3cccc(c3O)O

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Benzoic acids and derivatives

List of proteins that are targets for MCJ

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P80188_MCJ	P80188	n/a