PDB ligand accession: NS2
DrugBank: DB15031
PubChem:
ChEMBL:
InChI Key: NBGABHGMJVIVBW-QHCPKHFHSA-N
SMILES: COC1=CC(C(=O)N2CCC[C@@]2(C)C2=NC3=C(N2)C=CC(Cl)=C3C)=C(C=C1)N1N=CC=N1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
SER | 129 | O-linked_glycosylation | |||
TYR | 348 | Phosphorylation | PyMOL_Chai1 | ||
SER | 351 | Phosphorylation | PyMOL_RFAA |