Schiff bases | DmChDp | DmChDa | ||||||
---|---|---|---|---|---|---|---|---|
Binding energy (BE) (kcal/mol) and other interactions | -BE | H bond | Other | -BE | H bond | Other | ||
Target proteins and active site | 1T2P | 1 | 7.6 | 2 | 7 | 8 | 0 | 7 |
2 | 7.5 | 2 | 5 | 7.3 | 0 | 8 | ||
3 | 6.3 | 1 | 5 | 5.9 | 1 | 6 | ||
4 | 6.2 | 1 | 10 | 6.1 | 0 | 6 | ||
3U2D | 1 | 6.7 | 1 | 8 | 7.2 | 0 | 6 | |
2 | 6.8 | 1 | 5 | 7.1 | 0 | 9 | ||
3 | 6.8 | 1 | 3 | 7.2 | 0 | 7 | ||
4 | 6.9 | 0 | 6 | 7.1 | 0 | 10 | ||
2W9S | 1 | 9.3 | 1 | 8 | 9.1 | 0 | 14 | |
2 | 9.9 | 2 | 8 | 10.2 | 1 | 9 | ||
3 | 10.3 | 1 | 14 | 9.5 | 0 | 8 | ||
4 | 7 | 1 | 7 | 6.9 | 0 | 7 | ||
1N67 | 1 | 9 | 2 | 9 | 8.6 | 1 | 8 | |
2 | 9 | 2 | 7 | 6.6 | 1 | 4 | ||
3 | 9 | 1 | 11 | 8.5 | 1 | 9 | ||
4 | 9 | 2 | 7 | 8.4 | 1 | 8 | ||
2ZCO | 1 | 8.3 | 2 | 6 | 8 | 1 | 7 | |
2 | 7.8 | 2 | 6 | 5.9 | 0 | 2 | ||
3 | 7.6 | 1 | 6 | 7.1 | 0 | 6 | ||
4 | 8.4 | 3 | 6 | 8.1 | 1 | 4 | ||
4H8E | 1 | 7.8 | 3 | 8 | 7.5 | 0 | 8 | |
2 | 6.2 | 3 | 4 | 6.2 | 0 | 8 |