PDB ligand accession: AUP
DrugBank: DB07393
PubChem:
ChEMBL: n/a
InChI Key: GSKNNHAAFLPYHG-UHFFFAOYSA-N
SMILES: C1CCC2=C(P(C(=C2C1)C1=NC=CC=C1)C1=CC=CC=C1)C1=NC=CC=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
THR | 301 | Phosphorylation | PyMOL_RFAA | ||
SER | 303 | Phosphorylation | PyMOL_RFAA | ||
LYS | 300 | Ubiquitination |