Research Article
The Underlying Molecular Mechanisms Involved in Traditional Chinese Medicine Smilax china L. for the Treatment of Pelvic Inflammatory Disease
Table 2
Time-averaged H-bond properties obtained from MD simulation of five complexes.
| Protein | Ligand | H-bond (number) | H-bond distance (average, Å) | H-bond angle (average, °) | Detected H-bonds |
| PTGS2 | Isorhamnetin | 2.5 | 2.94 | 14.88 | 18 | MAPK1 | Moracin M | 4.0 | 2.85 | 16.15 | 19 | LCN2 | Rutin | 2.8 | 2.85 | 14.59 | 45 | TNF | Rutin | 2.2 | 2.94 | 16.93 | 25 | MMP9 | Oxyresveratrol | 4.3 | 2.78 | 14.78 | 20 |
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