PDB ligand accession: CIT
DrugBank: DB04272
PubChem: 311;19782904;88113319;
ChEMBL:
InChI Key: KRKNYBCHXYNGOX-UHFFFAOYSA-N
SMILES: OC(=O)CC(O)(CC(O)=O)C(O)=O
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
TYR | 60 | Nitration | PyMOL_Chai1 | ||
ASN | 119 | N-linked_glycosylation | |||
TYR | 149 | Phosphorylation | PyMOL_AF3 | PyMOL_Chai1 |