PDB ligand accession: 47D
DrugBank: DB07093
PubChem:
ChEMBL:
InChI Key: RQWICELTTDJODO-UHFFFAOYSA-N
SMILES: c1cc2c(cc1Cl)nc(s2)CN3C(=O)C=CN(C3=O)CC(=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 |
---|---|---|---|---|---|
2PDG | Download | Experimental | e2pdgA1 | TIM beta/alpha-barrel | LigPlot |
2PDN | Download | Experimental | e2pdnA1 | TIM beta/alpha-barrel | LigPlot |
2PDQ | Download | Experimental | e2pdqA1 | TIM beta/alpha-barrel | LigPlot |
2PDH | Download | Experimental | e2pdhA1 | TIM beta/alpha-barrel | LigPlot |