PDB ligand accession: BCN
DrugBank: DB03709
PubChem: 8761;5256512;
ChEMBL:
InChI Key: FSVCELGFZIQNCK-UHFFFAOYSA-N
SMILES: C(CO)N(CCO)CC(=O)O
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 |
|---|---|---|---|---|---|
| 7LV5 | Download | Experimental | e7lv5B2 | Rossmann-like | LigPlot |
| 7LTP | Download | Experimental | e7ltpB1 | Rossmann-like | LigPlot |
| 7K0B | Download | Experimental | e7k0bB1 e7k0bB2 | Rossmann-like Rossmann-like | LigPlot |
| 4HPJ | Download | Experimental | e4hpjB2 | Rossmann-like | LigPlot |
| 4HPX | Download | Experimental | e4hpxA1 e4hpxB2 | TIM beta/alpha-barrel Rossmann-like | LigPlot |
| 7L1H | Download | Experimental | e7l1hB2 | Rossmann-like | LigPlot |
| 5CGQ | Download | Experimental | e5cgqB2 | Rossmann-like | LigPlot |
| 6WX3 | Download | Experimental | e6wx3B1 | Rossmann-like | LigPlot |
| 7KYT | Download | Experimental | e7kytA1 e7kytB2 | TIM beta/alpha-barrel Rossmann-like | LigPlot |
| 7KWV | Download | Experimental | e7kwvB2 | Rossmann-like | LigPlot |
| 4HN4 | Download | Experimental | e4hn4B2 | Rossmann-like | LigPlot |
| 4HT3 | Download | Experimental | e4ht3A1 e4ht3B1 | TIM beta/alpha-barrel Rossmann-like | LigPlot |