PDB ligand accession: A21
DrugBank: DB07310
PubChem: 16105493;135513268;
ChEMBL:
InChI Key: KNHNFKZUNFPPQE-MADCSZMMSA-N
SMILES: C[C@H](NC1=NC(=O)[C@](C)(S1)C(F)(F)F)C1=C(F)C=CC=C1
Drug action: n/a
| 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 | 283 | Phosphorylation | PyMOL_RFAA | ||
| SER | 281 | Phosphorylation | PyMOL_RFAA | ||
| TYR | 284 | Phosphorylation | PyMOL_Chai1 | ||
| THR | 282 | Phosphorylation | PyMOL_RFAA |