PDB ligand accession: GCE
DrugBank: DB06040
PubChem:
ChEMBL:
InChI Key: LLXISKGBWFTGEI-FQEVSTJZSA-N
SMILES: CON(C)C(=O)N1N=C(S[C@@]1(CCCN)C1=CC=CC=C1)C1=CC(F)=CC=C1F
Drug action: n/a
| Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
|---|---|---|---|---|---|
| SER | 120 | Phosphorylation | PyMOL_RFAA | ||
| TYR | 125 | Phosphorylation | PyMOL_Chai1 | ||
| THR | 126 | Phosphorylation | PyMOL_RFAA | ||
| TYR | 211 | Phosphorylation | PyMOL_Chai1 | ||
| THR | 223 | Phosphorylation | PyMOL_RFAA | ||
| TYR | 231 | Phosphorylation | PyMOL_Chai1 | ||
| SER | 232 | Phosphorylation | PyMOL_RFAA | ||
| THR | 222 | Phosphorylation | PyMOL_RFAA | ||
| LYS | 207 | Ubiquitination | |||
| LYS | 216 | Ubiquitination | |||
| LYS | 197 | Ubiquitination | |||
| LYS | 60 | Acetylation | PyMOL_RFAA | ||
| LYS | 60 | Ubiquitination |