Table 1. Probability (p) Values Acquired by Consensus Computations from Moldock, Rerank, and Plants Score Algorithms of the Three PDB Mpro.
PDB
codes |
||||
---|---|---|---|---|
compounds | 5RG1 | 5RG2 | 5RG3 | 6LU7 |
2 | 0.638 | 0.7* | 0.585 | 0.524 |
2a | 0.709 | 0.765 | 0.579 | 0.564 |
2b | 0.684 | 0.504 | 0.611 | 0.723 |
2c | 0.77 | 0.822 | 0.879* | 0.641 |
2d | 0.721 | 0.482 | 0.641 | 0.579 |
2e | 0.775* | 0.627 | 0.472 | 0.658 |
2f | 0.897* | 0.461 | 0.688 | 0.728 |
2g | 0.962* | 0.637 | 0.909* | 0.779* |
2h | 0.882* | 0.946* | 0.852 | 0.686 |
2i | 0.903* | 0.584 | 0.579 | 0.749 |
2j | 0.835* | 0.521 | 0.752 | 0.685 |
2k | 0.822* | 0.817 | 0.872* | 0.733 |
2l | 0.583 | 0.688 | 0.559 | 0.491 |
2m | 0.59 | 0.662 | 0.717 | 0.547 |
Ebselen | 0.634 | 0.417 | 0.533 | 0.540 |
PDB ligand | 0.740 | 0.499 | 0.854 | 0.666 |