Research on the Mechanism of Asperosaponin VI for Treating Recurrent Spontaneous Abortion by Bioinformatics Analysis and Experimental Validation

Table 4

Molecular interactions of key targets with AS6.

Compound	Target	PDB ID	Affinity (kcal/mol)	Number of hydrogen bonds	Hydrogen bonds interacting residues
Asperosaponin VI	JUN	5FV8	−7.2	6	Gln-30 (2), Arg-5, Arg-21, Asp-26, Lys-22
Asperosaponin VI	CASP3	3DEI	−9.7	6	Arg-164 (4), Cys-264, Glu-124
Asperosaponin VI	STAT3	6NUQ	−7.6	5	Glu-324 (2), Ser-513, Gln-247, Cys-251
Asperosaponin VI	SRC	2SRC	−9.3	9	Glu-339 (2), His-319, Gln-253, Lys-152, Phe-150, Tyr-90, Thr-247, Ser-248
Asperosaponin VI	PTGS2	5F19	−10.5	3	Glu-236, Ser-143, Glu-140