PDB ligand accession: WY2
DrugBank: DB03970
PubChem:
ChEMBL: n/a
InChI Key: CHNMLWCTGYMVFH-GFCCVEGCSA-N
SMILES: c1c(nc2n1c3c(s2)CCC3)C4C(=CN=C(CS4)C(=O)O)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Thiazepines
- Subclass: Para thiazepines
- Class: Thiazepines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1Q2P | Download | Experimental | e1q2pA1 e1q2pA2 | alpha-helical domain in beta-lactamase/transpeptidase-like proteins Profilin-like | LigPlot |