Ligand name: (2S,4S,5R,7R)-4-AMINO-8-(BUTYLAMINO)-5-HYDROXY-2,7-DIMETHYL-8-OXOOCTYL 1-BENZYL-1H-INDOLE-3-CARBOXYLATE
PDB ligand accession: C80
DrugBank: n/a
PubChem: 49866757
ChEMBL: n/a
InChI Key: XZLFXZZCYRJLTI-PGVSFRRCSA-N
SMILES: CCCCNC(=O)C(C)CC(C(CC(C)COC(=O)c1cn(c2c1cccc2)Cc3ccccc3)N)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P00797

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2V11	Download	Experimental	e2v11C2 e2v11C3 e2v11O2 e2v11O3	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot