Ligand name: N-cyclopropyl-N-(trans-4-pyridin-3-ylcyclohexyl)-4-[(1S)-2,2,2-trifluoro-1-hydroxy-1-methylethyl]benzamide
PDB ligand accession: D3E
DrugBank: DB07619
PubChem: n/a
ChEMBL: CHEMBL452587
InChI Key: FLRYWTWLHWACRP-GRWTVWFQSA-N
SMILES: [H][C@@]1(CC[C@@]([H])(CC1)C1=CC=CN=C1)N(C1CC1)C(=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
ASN 123 N-linked_glycosylation
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