PDB ligand accession: K21
DrugBank: DB02929
PubChem:
ChEMBL:
InChI Key: KCWGETCFOVJEPI-UHFFFAOYSA-N
SMILES: COC1=CC=C2SCCN(CC2=C1)C(=O)CCN1CCC(CC2=CC=CC=C2)CC1
Drug action: n/a
| Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
|---|---|---|---|---|---|
| SER | 88 | O-linked_glycosylation | |||
| SER | 88 | Phosphorylation | PyMOL_RFAA | ||
| SER | 116 | Phosphorylation | PyMOL_RFAA | ||
| THR | 118 | Phosphorylation | PyMOL_RFAA | ||
| SER | 204 | Phosphorylation | PyMOL_RFAA | ||
| SER | 246 | Phosphorylation | PyMOL_RFAA | ||
| SER | 275 | Phosphorylation | PyMOL_RFAA | ||
| SER | 277 | Phosphorylation | PyMOL_RFAA | ||
| THR | 200 | Phosphorylation | PyMOL_RFAA | ||
| SER | 243 | Phosphorylation | PyMOL_RFAA | ||
| TYR | 250 | Phosphorylation | PyMOL_Chai1 | ||
| THR | 111 | Phosphorylation | PyMOL_RFAA |