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 |
---|---|---|---|---|---|
4MH2 | Download | Experimental | e4mh2A1 e4mh2B1 e4mh2C1 e4mh2D1 e4mh2E1 e4mh2F1 e4mh2G1 e4mh2H1 e4mh2I1 e4mh2J1 e4mh2K1 e4mh2L1 | Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like | LigPlot |
4MH3 | Download | Experimental | e4mh3A1 e4mh3B1 e4mh3C1 e4mh3D1 e4mh3G1 e4mh3H1 | Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like | LigPlot |