PDB ligand accession: B97
DrugBank: DB07430
PubChem:
ChEMBL:
InChI Key: CMWRPDHVGMHLSZ-GFCCVEGCSA-N
SMILES: [H][C@@]1(C)CNC2=C(SC3=C2C2=C(C=C3)N=C(C=C2)C2=CN=C(C)C=C2)C(=O)N1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
THR | 206 | Phosphorylation | PyMOL_RFAA | ||
LYS | 353 | Sumoylation | |||
LYS | 93 | Ubiquitination | |||
LYS | 204 | Ubiquitination | |||
LYS | 353 | Ubiquitination |