Curcumin-Based Inhibitors of Thrombosis and Cancer Metastasis Promoting Factor CLEC 2 from Traditional Medicinal Species Curcuma longa

Table 2

The interacting residues and their corresponding chain.

Name of ligand	Chain (A/B)	Interactions
		Hydrogen	Hydrophobic
15 piperine	B	Phe117 (3.06 Å), Arg118 (2.90 Å and 3.05 Å)	Tro106 (4.58 Å), Phe117 (4.98 Å) and Arg118 (4.36 Å)
8 bisdemethoxycurcumin	A	Arg107 (2.94 Å), Asn105 (2.98 Å, 3.09 Å), Trp106 (3.60 Å), Gly115 (3.43 Å) and His119 (3.74 Å)	—
11 demethoxycurcumin	A	Arg 107 (2.82 Å), Thr104 (3.40 Å), and Asn105 (3.40 Å, 3,23 Å)	Trp106 (3.93 Å, 4.91 Å), Phe117 (4.97 Å, 4.67 Å), Phe116 (4.67 Å)
12 dihydrocurcumin	B	Met133 (3.37 Å), Trp106 (2.92 Å), Asn105 (3.36, 3.71 Å)	—