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 P03369

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3HDK	Download	Experimental	e3hdkA1 e3hdkB1	cradle loop barrel cradle loop barrel	LigPlot
3HBO	Download	Experimental	e3hboA1 e3hboB1	cradle loop barrel cradle loop barrel	LigPlot
3KA2	Download	Experimental	e3ka2A1	cradle loop barrel	LigPlot
3NWQ	Download	Experimental	e3nwqA1 e3nwqB1	cradle loop barrel cradle loop barrel	LigPlot
3NYG	Download	Experimental	e3nygA1 e3nygB1	cradle loop barrel cradle loop barrel	LigPlot
3HAU	Download	Experimental	e3hauA1 e3hauB1	cradle loop barrel cradle loop barrel	LigPlot
3IAW	Download	Experimental	e3iawA1	cradle loop barrel	LigPlot
3HAW	Download	Experimental	e3hawA1 e3hawB1	cradle loop barrel cradle loop barrel	LigPlot
3FSM	Download	Experimental	e3fsmA1	cradle loop barrel	LigPlot
3HLO	Download	Experimental	e3hloA1	cradle loop barrel	LigPlot
4HVP	Download	Experimental	e4hvpB1 e4hvpA1	cradle loop barrel cradle loop barrel	LigPlot