PDB ligand accession: THA
DrugBank: DB00382
PubChem:
ChEMBL:
InChI Key: YLJREFDVOIBQDA-UHFFFAOYSA-N
SMILES: NC1=C2CCCCC2=NC2=CC=CC=C12
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
TYR | 174 | Phosphorylation | PyMOL_Chai1 | ||
SER | 226 | Phosphorylation | PyMOL_RFAA | ||
SER | 252 | Phosphorylation | PyMOL_Chai1 |