PDB | Protein | FPocketWeb Time (s) |
fpocket Time (s) | Score |
|---|
1HWL [20] | HMG-CoA reductase | 5.6 ± 0.095 | 5.1 ± 0.149 | 0.437 |
2P16 [21] | factor Xa | 0.7 ± 0.032 | 0.6 ± 0.009 | 0.961 |
3LN1 [22] | COX-2 | 15.9 ± 0.514 | 16.0 ± 0.145 | 0.630 |
4LL3 [23] | HIV protease | 0.4 ± 0.052 | 0.3 ± 0.015 | 0.862 |
4TZ4 | Cereblon | 5.2 ± 0.048 | 5.3 ± 0.075 | 0.301 |
- Times are reported in seconds. FPocketWeb and fpocket produced the same scores; we report the scores associated with the top-ranked pockets. The calculations were performed on PDB files downloaded directly from the Protein Data Bank, without further processing.
