Ligand name: N-{(2S)-2-[(N-acetyl-L-threonyl-L-isoleucyl)amino]hexyl}-L-norleucyl-L-glutaminyl-N~5~-[amino(iminio)methyl]-L-ornithinamide
PDB ligand accession: 2NC
DrugBank: n/a
PubChem: 49866429
ChEMBL: n/a
InChI Key: MQPXOVRKKPPKFZ-QYKDHROSSA-O
SMILES: CCCCC(CNC(CCCC)C(=O)NC(CCC(=O)N)C(=O)NC(CCCNC(=[NH2+])N)C(=O)N)NC(=O)C(C(C)CC)NC(=O)C(C(C)O)NC(=O)C
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 I7BFC3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6O5A	Download	Experimental	e6o5aA1 e6o5aB1	cradle loop barrel cradle loop barrel	LigPlot
6O57	Download	Experimental	e6o57A1 e6o57B1	cradle loop barrel cradle loop barrel	LigPlot