Ligand name: (S)-N-(1-(3-CHLORO-4-FLUOROPHENYL)-2-HYDROXYETHYL)-4-(4-(3-CHLOROPHENYL)-1H-PYRAZOL-3-YL)-1H-PYRROLE-2-CARBOXAMIDE
PDB ligand accession: 82A
DrugBank: DB07264
PubChem: 135449326
ChEMBL: CHEMBL387385
InChI Key: YMUYGRBBEDYUOP-HXUWFJFHSA-N
SMILES: [H][C@](CO)(NC(=O)C1=CC(=CN1)C1=NNC=C1C1=CC=CC(Cl)=C1)C1=CC(Cl)=C(F)C=C1
Drug action: n/a

List of small molecule binding-associated PTMs for P28482

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
SER	29	Phosphorylation		PyMOL_RFAA
SER	41	Phosphorylation		PyMOL_RFAA
THR	63	Phosphorylation		PyMOL_RFAA
THR	190	Phosphorylation		PyMOL_RFAA
TYR	64	Phosphorylation			PyMOL_Chai1
CYS	65	S-nitrosylation		PyMOL_RFAA
CYS	166	S-nitrosylation		PyMOL_RFAA