Ligand name: 1-{[(3R)-3-methyl-4-({4-[(1S)-2,2,2-trifluoro-1-hydroxy-1-methylethyl]phenyl}sulfonyl)piperazin-1-yl]methyl}cyclopropanecarboxamide
PDB ligand accession: D4N
DrugBank: DB07624
PubChem: 24856362
ChEMBL: CHEMBL460962
InChI Key: YJFULAYRAKPBCY-DYVFJYSZSA-N
SMILES: [H][C@@]1(C)CN(CC2(CC2)C(N)=O)CCN1S(=O)(=O)C1=CC=C(C=C1)[C@](C)(O)C(F)(F)F
Drug action: n/a

List of small molecule binding-associated PTMs for P28845

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
SER	196	Phosphorylation		PyMOL_RFAA
TYR	280	Phosphorylation			PyMOL_Chai1
SER	281	Phosphorylation		PyMOL_RFAA
THR	282	Phosphorylation		PyMOL_RFAA
SER	283	Phosphorylation		PyMOL_RFAA
TYR	284	Phosphorylation			PyMOL_Chai1
ASN	123	N-linked_glycosylation