Ligand name: (S)-2-amino-5-((R)-1-(carboxymethylamino)-3-((3S,4R)-1,4-dihydroxynonan-3-ylthio)-1-oxopropan-2-ylamino)-5-oxopentanoic acid
PDB ligand accession: BOB
DrugBank: n/a
PubChem: 46173031
ChEMBL: n/a
InChI Key: CLEVVMDJDMEQKG-XQLPTFJDSA-N
SMILES: CCCCCC(C(CCO)SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)O

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of proteins that are targets for BOB

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	O15217_BOB	O15217	n/a
2	P08263_BOB	P08263	n/a