PDB ligand accession: JMM
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: SMBREKYBPARCFW-UHFFFAOYSA-N
SMILES: c1cc(oc1)C(=O)N2CCN(CC2)C(=O)C3CC3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Carboxylic acid derivatives
- 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 |
---|---|---|---|---|---|
5S9U | Download | Experimental | e5s9uA1 e5s9uA2 e5s9uA3 e5s9uB1 e5s9uB2 e5s9uB3 | FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like | LigPlot |