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Table 3 The molecular docking results analysis. (The software of PyMol 2.3.2 was used to generate the protein structure figures)

From: Investigating the multi-target pharmacological mechanism of danhong injection acting on unstable angina by combined network pharmacology and molecular docking

No.

Proteins

PDB ID

Protein structure

Test compounds

Affinity (kcal/mol)

1

NFKB1

2O61

Caffeic acid

−6.1

2

TLR4

4G8A

Caffeic acid

−6.3

   

p-Coumaric acid

−5.7

   

Ferulic acid

−6.0

3

TNF

1TNF

Rosmarinic acid

−9.3

4

SERPINE1

1A7C

Protocatechuic acid

−6.1