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@article{815521,
author = {Wimmerová, Michaela and Mishra, Navnit Kumar and Pokorná, Martina and Koča, Jaroslav},
article_number = {6},
keywords = {protein-carbohydrate interaction; computational chemistry},
language = {eng},
issn = {1610-2940},
journal = {Journal of Molecular Modeling},
title = {Importance of oligomerisation on Pseudomonas aeruginosa Lectin-II binding affinity. In silico and in vitro mutagenesis.},
volume = {15},
year = {2009}
}
TY - JOUR
ID - 815521
AU - Wimmerová, Michaela - Mishra, Navnit Kumar - Pokorná, Martina - Koča, Jaroslav
PY - 2009
TI - Importance of oligomerisation on Pseudomonas aeruginosa Lectin-II binding affinity. In silico and in vitro mutagenesis.
JF - Journal of Molecular Modeling
VL - 15
IS - 6
SP - 673-679
EP - 673-679
SN - 16102940
KW - protein-carbohydrate interaction
KW - computational chemistry
N2 - The effect of terminal GLY114* deletion on the binding affinity of the PA-IIL lectin towards L fucose was investigated. Both experimental (Isothermal Titration Calorimetry) and computational (Molecular dynamics simulations) methods have shown that the deletion mutation decreases the L fucose affinity. It implies that the PA-IIL saccharide binding affinity is influenced by the dimerization of the lectin. A detailed analysis of computational data confirms the key role of electrostatic interactions in the PA-IIL/saccharide binding.
ER -
WIMMEROVÁ, Michaela, Navnit Kumar MISHRA, Martina POKORNÁ a Jaroslav KOČA. Importance of oligomerisation on Pseudomonas aeruginosa Lectin-II binding affinity. In silico and in vitro mutagenesis. \textit{Journal of Molecular Modeling}. roč.~15, č.~6, s.~673-679. ISSN~1610-2940. 2009.
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