PDB ligand accession: 4VT
DrugBank: n/a
PubChem: n/a
ChEMBL:
InChI Key: RAGSEECOXCGMEQ-UHFFFAOYSA-N
SMILES: c1ccc(cc1)CC2=CC(=O)n3c(c(cn3)C#N)N2
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 |
---|---|---|---|---|---|
5BWR | Download | Experimental | e5bwrA1 e5bwrA2 e5bwrB1 e5bwrA1 e5bwrA2 e5bwrB1 e5bwrB2 | 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 a+b domain in D-aminoacid aminotransferase-like PLP-dependent enzymes barrel domain in D-aminoacid aminotransferase-like PLP-dependent enzymes | LigPlot |