PDB ligand accession: MV7
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: RSTFVOGBJGGSOD-NDKACYJFSA-N
SMILES: CC(C)C(C(=O)NCc1ccccc1)NC(=O)C(CC(C(COc2cc(cc(c2)F)F)NC(=O)c3cc(cc(c3)N(C)S(=O)(=O)C)C(=O)NC(C)c4ccccc4)O)OCCOC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Peptidomimetics
- Subclass: Hybrid peptides
- Class: Peptidomimetics
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3I25 | Download | Experimental | e3i25A2 e3i25A3 e3i25A2 e3i25B2 e3i25B3 e3i25C2 e3i25C3 | cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel | LigPlot |