PDB ligand accession: 2TS
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: MWLLGEVAEDIFRC-PKTZIBPZSA-N
SMILES: c1ccc(cc1)CS(=O)(=O)NC(CCCNC(=N)N)C(=O)N2CCCC2C(=O)NCc3cc(ccc3CN)Cl
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 |
---|---|---|---|---|---|
3EQ0 | Download | Experimental | e3eq0.1 | cradle loop barrel | LigPlot |
5JFD | Download | Experimental | e5jfdH1 | cradle loop barrel | LigPlot |