<p>Root mean square deviation (RMSD) of heavy atoms of WT (<a href="http://www.plosone.org/article/info:doi/10.1371/journal.pone.0044057#pone-0044057-g002" target="_blank">Figure 2A</a>) and Q136K (<a href="http://www.plosone.org/article/info:doi/10.1371/journal.pone.0044057#pone-0044057-g002" target="_blank">Figure 2B</a>) in 1918 N1. <a href="http://www.plosone.org/article/info:doi/10.1371/journal.pone.0044057#pone-0044057-g002" target="_blank">Figure 2D and 2E</a> show heavy atoms RMSD of WT and Q136K of 2009 N1. Black, red, green color lines represent three times simulation of apo form structures. <a href="http://www.plosone.org/article/info:doi/10.1371/journal.pone.0044057#pone-0044057-g002" target="_blank">Figure 2C and 2F</a> show Ro...
<p>Secondary structure propensity of residues in WT and Q136K of 1918 N1 (<a href="http://www.ploson...
<p>A. Plot of root mean square deviation (RMSD) of model 1L P<sub>core</sub> Cα atoms versus simulat...
<p>The trend obtained from EhSAT1 & EhSAT3 showing slightly higher rmsd’s for the mutants compared t...
<p>(A) The backbone atom root mean square deviation (RMSD) for apo, inhibitor bound, apo (truncated)...
<p>(A) Control plots representing the stability of the models during the molecular dynamics run. The...
<p>Per-residue Root Mean Square Fluctuations (RMSF) of the hTop1, upper panel black line, and of the...
<p>The side chain root-mean-square fluctuations (RMSF) of the EcRDBD point mutants and the UspDBD (s...
<p>Rmsds were calculated using Cα atoms for histones (black lines) and P atoms for DNA excluding 20b...
(A) RMSF of I1 and I2 variants, and the M3 mutant, at 310 K. Line widths correspond to standard devi...
<p>Mean Root Mean Square Fluctuation (RMSF) computed for the C<i>α</i> atoms of the <i>µ</i>OR backb...
<p>The RMSD was calculated over the whole simulation process to check the stability of the unmodifie...
<p><b>a)</b> Cα atom RMSF in the 3 clusters obtained by clustering. Cyan dashed line: cluster #1 (i....
<p>a) Apo_form, b) SIRT2 bound with substrate/NAD<sup>+</sup>, and c) SIRT2 with inhibitor.</p
<p>Root mean square deviation (RMSD) from the crystallographic structures of the C<sup>α</sup> atoms...
<p>Deviations are averaged over C<sup>α</sup> fragments with a homogeneous secondary structure. Erro...
<p>Secondary structure propensity of residues in WT and Q136K of 1918 N1 (<a href="http://www.ploson...
<p>A. Plot of root mean square deviation (RMSD) of model 1L P<sub>core</sub> Cα atoms versus simulat...
<p>The trend obtained from EhSAT1 & EhSAT3 showing slightly higher rmsd’s for the mutants compared t...
<p>(A) The backbone atom root mean square deviation (RMSD) for apo, inhibitor bound, apo (truncated)...
<p>(A) Control plots representing the stability of the models during the molecular dynamics run. The...
<p>Per-residue Root Mean Square Fluctuations (RMSF) of the hTop1, upper panel black line, and of the...
<p>The side chain root-mean-square fluctuations (RMSF) of the EcRDBD point mutants and the UspDBD (s...
<p>Rmsds were calculated using Cα atoms for histones (black lines) and P atoms for DNA excluding 20b...
(A) RMSF of I1 and I2 variants, and the M3 mutant, at 310 K. Line widths correspond to standard devi...
<p>Mean Root Mean Square Fluctuation (RMSF) computed for the C<i>α</i> atoms of the <i>µ</i>OR backb...
<p>The RMSD was calculated over the whole simulation process to check the stability of the unmodifie...
<p><b>a)</b> Cα atom RMSF in the 3 clusters obtained by clustering. Cyan dashed line: cluster #1 (i....
<p>a) Apo_form, b) SIRT2 bound with substrate/NAD<sup>+</sup>, and c) SIRT2 with inhibitor.</p
<p>Root mean square deviation (RMSD) from the crystallographic structures of the C<sup>α</sup> atoms...
<p>Deviations are averaged over C<sup>α</sup> fragments with a homogeneous secondary structure. Erro...
<p>Secondary structure propensity of residues in WT and Q136K of 1918 N1 (<a href="http://www.ploson...
<p>A. Plot of root mean square deviation (RMSD) of model 1L P<sub>core</sub> Cα atoms versus simulat...
<p>The trend obtained from EhSAT1 & EhSAT3 showing slightly higher rmsd’s for the mutants compared t...