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 |
---|---|---|---|---|---|
8BUG | Download | Experimental | e8bugC1 e8bugF1 e8bugI2 | HTH HTH HTH | LigPlot |
8BUK | Download | Experimental | e8bukF2 | HTH | LigPlot |
8BUA | Download | Experimental | e8buaC1 e8buaF1 e8buaF2 e8buaI2 | HTH HTH HTH HTH | LigPlot |
8BU5 | Download | Experimental | e8bu5C1 e8bu5F2 e8bu5I1 | HTH HTH HTH | LigPlot |
8BUQ | Download | Experimental | e8buqC1 e8buqF2 e8buqI2 | HTH HTH HTH | LigPlot |
8BUC | Download | Experimental | e8bucF1 | HTH | LigPlot |
8BUB | Download | Experimental | e8bubC1 e8bubF1 | HTH HTH | LigPlot |