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Evidence-Based Complementary and Alternative Medicine
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Evidence-Based Complementary and Alternative Medicine
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2021
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Article
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Tab 3
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Research Article
Identification of Potential Bioactive Ingredients and Mechanisms of the Guanxin Suhe Pill on Angina Pectoris by Integrating Network Pharmacology and Molecular Docking
Table 3
Molecular binding information of NOS2 and top-5 ingredients.
Target
Compound
TCMSP ID
Contacting residue
Binding distance
Score
NOS2
Luteolin
MOL000006
ARG388
2.8
−9.5
VAL352
3.1
PHE369
2.8
NOS2
Quercetin
MOL000098
ARG388
3
−9.3
TYR347
2.3
VAL352
3.2
NOS2
Isorhamnetin
MOL000354
VAL352
3.4
−8.9
ASP382
2.3
ARG388
2.8
NOS2
Daidzein
MOL000390
TYR373
3
−8.9
ARG388
3.3, 3.3
ARG266
2.9, 3.4
NOS2
Kaempferol
MOL000422
ARG388
2.8
−8.9