PDB ligand accession: CIT
DrugBank: DB04272
PubChem: 311;19782904;88113319;
ChEMBL:
InChI Key: KRKNYBCHXYNGOX-UHFFFAOYSA-N
SMILES: C(C(=O)O)C(CC(=O)O)(C(=O)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Tricarboxylic acids and derivatives
- 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 |
---|---|---|---|---|---|
5NXI | Download | Experimental | e5nxiA1 | Carbonic anhydrase | LigPlot |
6UGO | Download | Experimental | e6ugoA1 | Carbonic anhydrase | LigPlot |
5THN | Download | Experimental | e5thnA1 | Carbonic anhydrase | LigPlot |
5THJ | Download | Experimental | e5thjA1 | Carbonic anhydrase | LigPlot |
6I3E | Download | Experimental | e6i3eA1 | Carbonic anhydrase | LigPlot |
5THI | Download | Experimental | e5thiA1 | Carbonic anhydrase | LigPlot |