Difference between revisions of "Normal mode analysis Gaucher Disease"
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<caption>The deformation energy for modes 7 to 20 for protein structure 2NT0 chain A from Webnma@.</caption> |
<caption>The deformation energy for modes 7 to 20 for protein structure 2NT0 chain A from Webnma@.</caption> |
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<figure id="fig:Eingenvalues_plot"> |
<figure id="fig:Eingenvalues_plot"> |
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[[File:Eingenvalues_plot_2NT0.png|thumb|400px|left|<caption> The Eigenvalues Plot for for protein structure 2NT0 chain A from Webnma@.</caption>]] |
[[File:Eingenvalues_plot_2NT0.png|thumb|400px|left|<caption> The Eigenvalues Plot for for protein structure 2NT0 chain A from Webnma@.</caption>]] |
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=== Atomic Displacement === |
=== Atomic Displacement === |
Revision as of 02:34, 7 July 2012
Contents
Introduction
Technical details are reported in our protocol
WEBnm@
Deformation Energies
"Deformation energies and eigenvalues reflect the energy associated with each mode and are inversely related to the amplitude of the motion described by a the corresponding modes. The protein structure moves along all the normal modes at once. A mode should only be interpreted in isolation if it is energetically well separated from other modes. " - from Webnma@
Below are the values of the deformation energy for modes 7 to 20.
<figtable id="tab:defor_enery">
Mode Index | Deformation Energy | Mode Index | Deformation Energy | ||
---|---|---|---|---|---|
7 | 1663.91 | 14 | 6698.31 | ||
8 | 2377.48 | 15 | 9791.69 | ||
9 | 2720.71 | 16 | 9534.10 | ||
10 | 5191.86 | 17 | 10022.74 | ||
11 | 5033.67 | 18 | 11137.44 | ||
12 | 6174.70 | 19 | 11592.80 | ||
13 | 6360.72 | 20 | 12045.03 |
The deformation energy for modes 7 to 20 for protein structure 2NT0 chain A from Webnma@. </figtable>
<figure id="fig:Eingenvalues_plot">
</figure>