Ligand name: Abrocitinib
PDB ligand accession: D7D
DrugBank: DB14973
PubChem: n/a
ChEMBL: CHEMBL3655081
InChI Key: IUEWXNHSKRWHDY-PHIMTYICSA-N
SMILES: CCCS(=O)(=O)N[C@H]1C[C@H](C1)N(C)C1=C2C=CNC2=NC=N1
Drug action: n/a

List of small molecule binding-associated PTMs for O60674

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
TYR	931	Phosphorylation		PyMOL_RFAA	PyMOL_Chai1
TYR	934	Phosphorylation		PyMOL_RFAA	PyMOL_Chai1
SER	936	Phosphorylation		PyMOL_RFAA
TYR	940	Phosphorylation		PyMOL_RFAA	PyMOL_Chai1