Ligand name: (S)-N-(4-carbamimidoylbenzyl)-1-(3-cyclopentylpropanoyl)pyrrolidine-2-carboxamide
PDB ligand accession: 49U
DrugBank: DB07095
PubChem: 24963037
ChEMBL: CHEMBL1198650
InChI Key: BNCHHUFGEOJCNH-SFHVURJKSA-N
SMILES: [H][C@]1(CCCN1C(=O)CCC1CCCC1)C(=O)NCC1=CC=C(C=C1)C(N)=N
Drug action: n/a

List of small molecule binding-associated PTMs for P00734

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
LYS	599	Acetylation			PyMOL_Chai1
THR	540	Phosphorylation			PyMOL_Chai1