PDB ligand accession: I52
DrugBank: DB01630
PubChem:
ChEMBL:
InChI Key: YJNCFXPJICILOK-HHHXNRCGSA-N
SMILES: CCCCCC1=CC=C(C=C1)C(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CCN1CCOCC1)[C@H](C(C)C)C(=O)NO
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
THR | 199 | Phosphorylation | PyMOL_Chai1 | ||
SER | 205 | Phosphorylation | PyMOL_Chai1 |