PDB ligand accession: 4W6
DrugBank: n/a
PubChem: n/a
ChEMBL:
InChI Key: IBJDXQJWRXJZBH-UHFFFAOYSA-N
SMILES: CCCC1=CC(=O)n2c(c(c(n2)CC(=O)N3CCCC3)C#N)N1
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyrazolopyrimidines
- Subclass: Pyrazolo[1,5-a]pyrimidines
- Class: Pyrazolopyrimidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5BWW | Download | Experimental | e5bwwA1 e5bwwA2 e5bwwB2 e5bwwA1 e5bwwA2 e5bwwB1 e5bwwB2 | barrel domain in D-aminoacid aminotransferase-like PLP-dependent enzymes a+b domain in D-aminoacid aminotransferase-like PLP-dependent enzymes a+b domain in D-aminoacid aminotransferase-like PLP-dependent enzymes barrel domain in D-aminoacid aminotransferase-like PLP-dependent enzymes a+b domain in D-aminoacid aminotransferase-like PLP-dependent enzymes barrel domain in D-aminoacid aminotransferase-like PLP-dependent enzymes a+b domain in D-aminoacid aminotransferase-like PLP-dependent enzymes | LigPlot |