The inhibition mechanism of tiliroside towards CYP2C9 was elucidated using molecular docking methods. Protein data bank (http://www.rcsb.org/pdb) is the source of CYP2C9, which PDB code is 1OG5. The structure was processed using the protein preparation wizard in the Schrödinger suite of programs, the missing residues in the middle of the chain was added, and hydrogen atoms were assigned. The two-dimensional structure of tiliroside was drawn using ChemDraw software with standard lengths and angles. Warfarin was firstly removed from the active s...
