PDB ligand accession: DMO
DrugBank: DB03856
PubChem:
ChEMBL:
InChI Key: VLCYCQAOQCDTCN-ZCFIWIBFSA-N
SMILES: C(CC(C(F)F)(C(=O)O)N)CN
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 |
---|---|---|---|---|---|
2TOD | Download | Experimental | e2todA4 e2todB3 e2todB4 e2todA3 e2todA4 e2todB4 e2todC4 e2todD3 e2todD4 e2todC3 e2todC4 e2todD4 | cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel | LigPlot |