PDB ligand accession: CNQ
DrugBank: DB03509
PubChem:
ChEMBL: n/a
InChI Key: FLYGLPYJEQPCFY-UHFFFAOYSA-N
SMILES: NC(=O)C1=CC=CC2=NC=C(N=C12)C1=CC=C(Cl)C=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
ARG | 878 | Methylation | PyMOL_RFAA PyMOL_RFAA PyMOL_RFAA | ||
SER | 864 | Phosphorylation | PyMOL_RFAA | ||
MET | 900 | Sulfoxidation | PyMOL_RFAA |