Ligand name: 4-Morpholin-4-Yl-Piperidine-1-Carboxylic Acid [1-(3-Benzenesulfonyl-1-Propyl-Allylcarbamoyl)-2-Phenylethyl]-Amide
PDB ligand accession: MYP
DrugBank: DB02243
PubChem: 168313589
ChEMBL: n/a
InChI Key: OFBHNKJTHNHXQT-WNJJXGMVSA-N
SMILES: [H][C@](CCC)(C=CS(=O)(=O)C1=CC=CC=C1)N=C(O)[C@]([H])(CC1=CC=CC=C1)N=C(O)N1CCC(CC1)N1CCOCC1
Drug action: n/a

List of small molecule binding-associated PTMs for Q9UBX1

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
THR	476	Phosphorylation			PyMOL_Chai1