PDB ligand accession: CPK
DrugBank: DB07580
PubChem: n/a
ChEMBL: n/a
InChI Key: GNQQJZKGGHOMBD-RDAHUFKRSA-N
SMILES: [H][C@@]1(CO[C@](C)(OC1)C(O)=O)OC(=O)N1CCN(CC1)C(=O)O[C@@]1([H])CO[C@](C)(OC1)C(O)=O
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 84 | Acetylation | PyMOL_Chai1 |