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 | 25 | Acetylation | PyMOL_RFAA | ||
LYS | 25 | Malonylation | PyMOL_RFAA | ||
SER | 60 | Phosphorylation | PyMOL_RFAA | ||
SER | 70 | Phosphorylation | PyMOL_RFAA | ||
SER | 203 | Phosphorylation | PyMOL_RFAA | ||
SER | 91 | Phosphorylation | PyMOL_RFAA | ||
TYR | 94 | Phosphorylation | PyMOL_Chai1 |