PDB ligand accession: 2KD
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: LTZGVONWBPMCBP-DEOSSOPVSA-N
SMILES: COC(=O)C(Cc1ccc(cc1)O)NC(=O)c2cc(c3cc(ccc3n2)c4cccc(c4)Cl)C(=O)O
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 |
---|---|---|---|---|---|
4NJ3 | Download | Experimental | e4nj3A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |