PDB ligand accession: F42
DrugBank: DB03913
PubChem:
ChEMBL: n/a
InChI Key: GEHSZWRGPHDXJO-NALJQGANSA-N
SMILES: CC(C(=O)NC(CCC(=O)NC(CCC(=O)O)C(=O)O)C(=O)O)OP(=O)(O)OCC(C(C(CN1c2cc(ccc2C=C3C1=NC(=O)NC3=O)O)O)O)O
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 |
---|---|---|---|---|---|
3R5Y | Download | Experimental | e3r5yA1 e3r5yB1 e3r5yC1 e3r5yD1 | cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel | LigPlot |