PDB ligand accession: RO4
DrugBank: DB08482
PubChem:
ChEMBL:
InChI Key: XKRONJXEXGFBRZ-ZNMIVQPWSA-N
SMILES: [H][C@@](C)(NC(=O)[C@]([H])(CC(C)C)NC(=O)[C@]([H])(CC(C)C)CC(=O)NO)C(=O)OCC
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
SER | 172 | Phosphorylation | PyMOL_Chai1 |