PDB ligand accession: DZG
DrugBank: DB07697
PubChem:
ChEMBL:
InChI Key: HMGDKYUJSFVHIY-UHFFFAOYSA-N
SMILES: COC1=CC=C(C=C1)S(=O)(=O)N1CCN(CC1)S(=O)(=O)C1=CC=C2OCCOC2=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 311 | Acetylation | PyMOL_RFAA | ||
ARG | 319 | Methylation | PyMOL_RFAA PyMOL_RFAA PyMOL_RFAA | ||
ARG | 467 | Methylation | PyMOL_RFAA PyMOL_RFAA PyMOL_RFAA | ||
TYR | 390 | Phosphorylation | PyMOL_Chai1 | ||
TYR | 444 | Phosphorylation | PyMOL_Chai1 | ||
THR | 25 | Phosphorylation | PyMOL_RFAA | ||
LYS | 311 | Ubiquitination |