PDB ligand accession: FIT
DrugBank: DB01216
PubChem:
ChEMBL:
InChI Key: DBEPLOCGEIEOCV-WSBQPABSSA-N
SMILES: [H][C@@]12CC[C@H](C(=O)NC(C)(C)C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@@]2([H])NC(=O)C=C[C@]12C
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
TYR | 56 | Phosphorylation | PyMOL_Chai1 | ||
TYR | 58 | Phosphorylation | PyMOL_Chai1 | ||
SER | 169 | Phosphorylation | PyMOL_RFAA |