PDB ligand accession: CIR
DrugBank: DB00155
PubChem: 9750;6992098;
ChEMBL:
InChI Key: RHGKLRLOHDJJDR-BYPYZUCNSA-N
SMILES: N[C@@H](CCCNC(N)=O)C(O)=O
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
SER | 32 | Phosphorylation | PyMOL_RFAA | ||
CYS | 222 | S-nitrosylation | PyMOL_RFAA | ||
CYS | 274 | S-nitrosylation | PyMOL_RFAA |