Basic Study
Copyright ©The Author(s) 2025.
World J Diabetes. May 15, 2025; 16(5): 103915
Published online May 15, 2025. doi: 10.4239/wjd.v16.i5.103915
Table 1 The binding energy of potential targets and contacts (kcal/mol)
Potential targets
Affinity (kcal/mol)
Contacts
ACE-4.37ALA-356 ASP-358
MMP2-7.35ALA-136 LEU-137 HIS-120 ARG-149
MMP9-7.35ALA-189 PRO-246 ALA-242 LEU-243 ARG-249
SI-3.09GLU-687 ARG-682 ILE-763 ASP-796 GLU-678
AKR1B1-9.35ALA-299 LEU-300 SER-302
MGAM-4.64CYS-15 PHE-161 ASN-71
HK1-2.22ASP-648
MMP1-5.5GLU-135 LYS-151 PHE-149 SER-142
IL-2-4.43GLU-60 ASN-90 SER-87 GLU-67
STAT3-2.78TYR-686 LYS-573 ALA-578 LEU-577 LEU-579