PDB ligand accession: MRQ
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: JGEVKUBHQRCGEE-DQEYMECFSA-N
SMILES: c1ccc2c(c1)CN(CC(=O)n3cccc3CC(=O)NC(C(=O)NC(CSC2)C(=O)N)CCCNC(=N)N)Cc4ccco4
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 |
---|---|---|---|---|---|
6T7H | Download | Experimental | e6t7hH1 | cradle loop barrel | LigPlot |