Ligand name: N-Methylphenylalanyl-N-[(trans-4-aminocyclohexyl)methyl]-L-prolinamide
PDB ligand accession: MIN
DrugBank: DB08187
PubChem: n/a
ChEMBL: CHEMBL125181
InChI Key: MDSVGJAUFNXYRR-WTGUMLROSA-N
SMILES: CN[C@H](CC1=CC=CC=C1)C(=O)N1CCC[C@H]1C(=O)NC[C@H]1CC[C@H](N)CC1
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