PDB ligand accession: BFQ
DrugBank: DB00710
PubChem: 60852;146015366;
ChEMBL:
InChI Key: MPBVHIBUJCELCL-UHFFFAOYSA-N
SMILES: CCCCCN(C)CCC(O)(P(O)(O)=O)P(O)(O)=O
Drug action: n/a
| Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
|---|---|---|---|---|---|
| LYS | 123 | Acetylation | PyMOL_RFAA | ||
| LYS | 123 | Malonylation | PyMOL_RFAA | ||
| TYR | 265 | Phosphorylation | PyMOL_Chai1 | ||
| SER | 334 | Phosphorylation | PyMOL_RFAA | ||
| TYR | 259 | Phosphorylation | PyMOL_Chai1 | ||
| SER | 271 | Phosphorylation | PyMOL_RFAA | ||
| LYS | 123 | Ubiquitination | |||
| LYS | 332 | Ubiquitination |