Table 1.
Binding affinity (BA) in Kcal/mol and the Ki values in µM resulting from docking of GLU (glutamate), EKP and KPA in both monomeric and dimeric models of enzymes gad67 and gad65 of Danio rerio.
| Ki | gad67 (µM) | gad65 (µM) | ||
|---|---|---|---|---|
| Monomer | Dimer | Monomer | Dimer | |
| GLU | 881.4 | 29.1 | 871.9 | 30.1 |
| EKP | 1110.6 | 45.8 | 1163.0 | 55.2 |
| KPA | 749.3 | 35.6 | 820.2 | 41.4 |
| BA | gad67 (kcal/mol) | gad65 (kcal/mol) | ||
| GLU | −4.18 | −6.20 | −4.18 | −6.18 |
| EKP | −4.04 | −5.93 | −4.01 | −5.82 |
| KPA | −4.28 | −6.08 | −4.22 | −5.99 |
EKP (values in bold) shows similar results in comparison to GLU and KPA.