Table 3 Docking Energies and H-Bond Distances with the surrounding residues
Compounds | Binding | H-bond | ||
|---|---|---|---|---|
scores | distance (Ã…) | |||
| Â | Arg38 | Lys43 | Glu62 | |
1 | −6.7 | ----- | ------ | ------ |
2 | −10.8 | 2.8 (NH2ϵ) and 2.2 (NH2ŋ2) | ------ | ------ |
3 | −9.8 | 2.9 Å (NH2ϵ) and 3.5 Å (NH2ŋ2) | ------ | ------ |
4 | −26.0 | ------ | 2.9 Å (NH2) | 2.8 Å (O1) and 3.0 Å (O2) |
Prednisolone | −28.2 | ----- | 2.44 | 3.34 |