PDB ligand accession: T04
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: NEGUDZMAJDITEM-RMFUMNGISA-N
SMILES: c1cc(ccc1C=C2C(=O)NC(=S)S2)NCc3ccc(c(c3)C(=O)NC(CCC(=O)O)C(=O)O)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2Y68 | Download | Experimental | e2y68A1 e2y68A2 e2y68A3 | Rossmann-like P-loop domains-like MurD-like peptide ligases, peptide-binding domain | LigPlot |