PDB ligand accession: DAN
DrugBank: DB03991
PubChem:
ChEMBL:
InChI Key: JINJZWSZQKHCIP-UFGQHTETSA-N
SMILES: [H][C@]1(OC(=C[C@H](O)[C@H]1NC(C)=O)C(O)=O)[C@H](O)[C@H](O)CO
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
THR | 122 | Phosphorylation | PyMOL_RFAA | ||
TYR | 20 | Phosphorylation | PyMOL_Chai1 |