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. 2023 Feb 12;17:11779322231154148. doi: 10.1177/11779322231154148

Table 2.

Molecular dynamics (MD) results from different models involving thyrotropin and your receptor.

Model ΔGbind (kcal/mol) RMSD (Å) ΔGPMF (kcal/mol)
1. hTSH:hTSHR −79.9 ± 0.1 3.2–4.4 13.3 ± 0.4
2. ag-TSH:sfTSHR −73.0 5.8 13.1 ± 0.5
3. ag-TSH:hTSHR −38.0 ± 2 6.3–12.6 5.6 ± 0.6

Abbreviations: PMF, potential of mean force; RMSD, root mean square deviation.