Table 3. Using the Active Site Prediction and Analysis Server, DoGSiteScorer, 3CJJ (Receptor for Advanced Glycation End Products) pockets and descriptors are provided.
Cavity number | Volume [ų] | Surface [Ų] | Drug Score | Simple Score |
P0 | 452.8 | 769.31 | 0.65 | 0.31 |
P1 | 340.14 | 583.56 | 0.6 | 0.18 |
P2 | 245.46 | 472.66 | 0.66 | 0.09 |
P3 | 186.15 | 453.42 | 0.33 | 0.04 |
P4 | 175.2 | 439.35 | 0.31 | 0.11 |
P5 | 159.26 | 381.93 | 0.21 | 0.03 |