PDB ligand accession: 4Z8
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: MTUQMGZENJYREJ-UHFFFAOYSA-N
SMILES: Cc1nc2cnc(cc2n1C(C)C)Nc3ccnc(n3)NCC(C)(C)C(=O)N
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 |
---|---|---|---|---|---|
5CAL | Download | Experimental | e5calA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |