PDB ligand accession: SHH
DrugBank: DB02546
PubChem:
ChEMBL:
InChI Key: WAEXFXRVDQXREF-UHFFFAOYSA-N
SMILES: ONC(=O)CCCCCCC(=O)NC1=CC=CC=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 31 | Acetylation | PyMOL_RFAA | ||
LYS | 200 | Acetylation | PyMOL_RFAA | ||
CYS | 261 | Glutathionylation | PyMOL_RFAA | ||
TYR | 204 | Phosphorylation | PyMOL_Chai1 | ||
SER | 197 | Phosphorylation | PyMOL_RFAA | ||
TYR | 303 | Phosphorylation | PyMOL_Chai1 | ||
THR | 304 | Phosphorylation | PyMOL_RFAA | ||
LYS | 200 | Ubiquitination |