PDB ligand accession: YZ9
DrugBank: DB02728
PubChem:
ChEMBL:
InChI Key: IETDBZQIWIJQJG-UHFFFAOYSA-N
SMILES: CCOC(=O)C1=CC2=CC=C(O)C=C2OC1=O
Drug action: n/a
| Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
|---|---|---|---|---|---|
| SER | 112 | O-linked_glycosylation | |||
| THR | 113 | O-linked_glycosylation | |||
| TYR | 37 | Phosphorylation | PyMOL_Chai1 | ||
| TYR | 76 | Phosphorylation | PyMOL_Chai1 | ||
| MET | 3 | Sulfoxidation | PyMOL_RFAA | ||
| ARG | 94 | Methylation | PyMOL_RFAA PyMOL_RFAA PyMOL_RFAA | ||
| CYS | 60 | S-nitrosylation | PyMOL_RFAA |