TABLE 5.

Basic information on the molecular docking of aloe-emodin and target proteins.

Ligand	Targets	Residues	Hydrogen bond length	Bindig energy (kcal/Mol)
Aloe-emodin	AKT1	ASN-204; SER-205; LYS-268	2.6,2.4; 2.0,1.9; 2.3	−5.94
Aloe-emodin	TP53	SER-227; GLU-221	2.2,2.8,2.4; 2.2	−5.08
Aloe-emodin	ALB	GLU-465; THR-478	2.6; 1.9	−4.46
Aloe-emodin	ESR1	TRP-383; GLU-380	1.8; 2.1	−5.28
Aloe-emodin	TNF	EU-145; PHE-143; HIS-140	2.3; 2.5,2.2; 2.6,2.2	−4.33
Aloe-emodin	STAT3	GLY-541; GLB-543; LYS-548	1.9; 2.5; 2.3	−3.03
Aloe-emodin	CASP3	THR-77; LYS-224; ASP-228	2.5; 2.5; 2.2	−4.80
Aloe-emodin	EGFR	ASP-800; CYS-797; ARG-841; ASN-842	2.5; 1.8; 2.1; 1.9	−5.24
Aloe-emodin	SRC	ESR-36; GLU-37	2.3; 2.2	−5.14
UC8	AKT1	GLU-242	1.9	−4.54
R4F	TP53	ALA-159; SER-227	1.9; 1.8	−4.48
MYR	ALB	GLN-417; LYS-534; TYR-497	2.4; 2.6; 2.1	−2.47
VQI	ESR1	ASP-369; ALA-307; LEU-308	2.1; 2.0; 1.8	−5.07
SO4	TNF	-	-	−5.43
KQV	STAT3	-	-	0.56
161	CASP3	ARG-101; LYS-105; ASP-146; ARG-149	1.7; 1.9; 3.0; 2.1	−2.72
03P	EGFR	ASP-984; GLN-812	2.1; 2.1	−3.43
821	SRC	THR-106	2.2	−5.43