PDB ligand accession: BCZ
DrugBank: DB06614
PubChem: 154234;86310107;
ChEMBL:
InChI Key: XRQDFNLINLXZLB-CKIKVBCHSA-N
SMILES: CCC(CC)C(C1C(CC(C1O)C(=O)O)NC(=N)N)NC(=O)C
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 |
---|---|---|---|---|---|
3K37 | Download | Experimental | e3k37A1 e3k37B1 | beta-propeller-like beta-propeller-like | LigPlot |
3K39 | Download | Experimental | e3k39A1 e3k39B1 e3k39C1 e3k39D1 e3k39E1 e3k39F1 e3k39G1 e3k39H1 e3k39I1 e3k39J1 e3k39K1 e3k39L1 e3k39M1 e3k39N1 e3k39O1 e3k39P1 | beta-propeller-like beta-propeller-like beta-propeller-like beta-propeller-like beta-propeller-like beta-propeller-like beta-propeller-like beta-propeller-like beta-propeller-like beta-propeller-like beta-propeller-like beta-propeller-like beta-propeller-like beta-propeller-like beta-propeller-like beta-propeller-like | LigPlot |