PDB ligand accession: 123
DrugBank: DB01905
PubChem:
ChEMBL: n/a
InChI Key: ZFCKHJJALHETHG-UHFFFAOYSA-O
SMILES: COC1=CC=C(O)C(=C1)C1=NC2=C(N1)C=CC(=C2)C(N)=[NH2+]
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
SER | 323 | Phosphorylation | PyMOL_Chai1 | ||
THR | 316 | Phosphorylation | PyMOL_Chai1 | ||
TYR | 326 | Phosphorylation | PyMOL_Chai1 | ||
TYR | 328 | Phosphorylation | PyMOL_Chai1 | ||
THR | 335 | Phosphorylation | PyMOL_Chai1 | ||
SER | 395 | Phosphorylation | PyMOL_Chai1 |