PDB ligand accession: 78P
DrugBank: DB07232
PubChem:
ChEMBL:
InChI Key: JNAHVYVRKWKWKQ-CYBMUJFWSA-N
SMILES: C[C@@]1(CCCN1)C1=NC2=CC=CC(C(N)=O)=C2N1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
ARG | 878 | Methylation | PyMOL_Chai1 PyMOL_Chai1 | ||
SER | 864 | Phosphorylation | PyMOL_Chai1 | ||
MET | 900 | Sulfoxidation | PyMOL_Chai1 | ||
SER | 721 | Phosphorylation | PyMOL_Chai1 |