PDB ligand accession: B49
DrugBank: DB01268
PubChem:
ChEMBL:
InChI Key: WINHZLLDWRZWRT-ATVHPVEESA-N
SMILES: CCN(CC)CCNC(=O)C1=C(C)NC(\C=C2/C(=O)NC3=C2C=C(F)C=C3)=C1C
Drug action: n/a
| Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
|---|---|---|---|---|---|
| TYR | 561 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
| TYR | 809 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
| THR | 562 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
| THR | 567 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
| TYR | 723 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
| LYS | 586 | Ubiquitination |