PDB ligand accession: GK1
DrugBank: DB07832
PubChem:
ChEMBL:
InChI Key: VKQPTVJDZIILPG-UHFFFAOYSA-N
SMILES: CC1=C(NC2=CC=NC3=CC(=CC=C23)C2=CSC(C=O)=N2)C=C(O)C=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 53 | Acetylation | PyMOL_RFAA | ||
SER | 28 | Phosphorylation | PyMOL_RFAA | ||
SER | 37 | Phosphorylation | PyMOL_RFAA |