10.1371/journal.pone.0071149.g005
Jeremie Topin
Jeremie
Topin
Julie Arnaud
Julie
Arnaud
Anita Sarkar
Anita
Sarkar
Aymeric Audfray
Aymeric
Audfray
Emilie Gillon
Emilie
Gillon
Serge Perez
Serge
Perez
Helene Jamet
Helene
Jamet
Annabelle Varrot
Annabelle
Varrot
Anne Imberty
Anne
Imberty
Aline Thomas
Aline
Thomas
Energy maps and docked conformations.
Public Library of Science
2013
Biochemistry
proteins
protein structure
Biochemistry simulations
Biomacromolecule-ligand interactions
glycobiology
biophysics
Biophysics simulations
Computational biology
genomics
Structure prediction
Macromolecular structure analysis
Biochemical simulations
Biophysic al simulations
microbiology
Host-pathogen interaction
computational chemistry
Molecular mechanics
Infectious diseases
Bacterial diseases
Burkholderia infection
Pseudomonas infections
maps
docked
2013-08-19 03:50:12
Figure
https://plos.figshare.com/articles/figure/_Energy_maps_and_docked_conformations_/776324
<p>Isoenergy contrours (1 kcal/mole) are represented as a function of Φ (x-axis) and Ψ (y-axis)torsion angles for all glycosidic linkages of interest taken from Glyco3D (<a href="http://glyco3d.cermav.cnrs.fr/" target="_blank">http://glyco3d.cermav.cnrs.fr/</a>) with superimposition of oligosaccharide conformations derived from docking (circles and squares) or protein crystallography (stars). Torsion angles are defined as Φ = θ(O5-C1-O1-Cx) and Ψ = θ(C1-O1-C′x-C′x+1).</p>