PDB ligand accession: 48I
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: SRSCMKAWNIMFBH-UHFFFAOYSA-N
SMILES: c1cc(c(cc1CN2C(=O)C=CN(C2=O)CC(=O)O)[N+](=O)[O-])Cl
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 |
---|---|---|---|---|---|
4XZH | Download | Experimental | e4xzhA1 e4xzhB1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |