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. 2022 Mar 18;11(6):1690. doi: 10.3390/jcm11061690

Figure 4.

Figure 4

Predicted M3R peptide binders docked on HLA-DRB1*0103. (A,B) Based on the prediction by SMM-align using IEDB the top two peptides with IC50 values of 120 and 121 were docked onto the crystal structure of HLA-DRB1*0103 PDB structure 1A6A, and the most optimum predicted position of docking is indicated for both peptides AWVISFVLWAPAILF and ISFVLWAPAILFWQY with the core sequence of AWVISFVLW and VLWAPAILF, respectively. (C,D) The highlighted region indicates the presence of the peptides in the three-dimensional structure of the M3R protein.