Ligand name: (S)-N-(4-carbamimidoylbenzyl)-1-(3-cyclohexylpropanoyl)pyrrolidine-2-carboxamide
PDB ligand accession: 50U
DrugBank: DB07131
PubChem: 25134248
ChEMBL: CHEMBL1198138
InChI Key: DOTBZTLJSXFKCP-IBGZPJMESA-N
SMILES: c1cc(ccc1CNC(=O)C2CCCN2C(=O)CCC3CCCCC3)C(=N)N
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 drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P00734

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2ZG0	Download	Experimental	e2zg0.1	cradle loop barrel	LigPlot