Modelling of ICAM-1 and LFA-1 interaction using molecular recognition theory

Summary: The model of ICAM-1 and LFA-1 molecular interaction was used to test the application of the Molecular Recognition Theory for the identification of several discontinuous binding regions, i.e. ligand-receptor sites, within large antigenic molecules. Molecular Recognition Theory is an applicab...

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Permalink: http://skupni.nsk.hr/Record/nsk.NSK01000717390/Details
Matična publikacija: Croatica chemica acta
81 (2008), 2 ; str. 283-287
Glavni autor: Štambuk, Nikola (-)
Ostali autori: Konjevoda, Paško (-), Vikić-Topić, Dražen, Pokrić, Biserka
Vrsta građe: Članak
Jezik: eng
Predmet:
Online pristup: CROATICA CHEMICA ACTA
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100 1 |a Štambuk, Nikola 
245 1 0 |a Modelling of ICAM-1 and LFA-1 interaction using molecular recognition theory /  |c Nikola Štambuk, Paško Konjevoda, Dražen Vikić-Topić, Biserka Pokrić. 
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500 |a 22nd Dubrovnik International Course & Conference MATH / CHEM / COMP 2007, Dubrovnik, June 11–16, 2007 
504 |a Bibliografija: 23 jed. 
504 |a Sažetak 
520 8 |a Summary: The model of ICAM-1 and LFA-1 molecular interaction was used to test the application of the Molecular Recognition Theory for the identification of several discontinuous binding regions, i.e. ligand-receptor sites, within large antigenic molecules. Molecular Recognition Theory is an applicable heuristic algorithm for identification of possibly interacting amino acid pairs in short linear epitope/paratope sites within larger molecules. However, in order to achieve better efficiency this heuristic algorithm of molecular recognition has to be combined to several other procedures: molecular hydropathy analyses, secondary structure prediction methods and protein database search. The limitation of the combined MRT-hydropathy analyses is in the fact that it cannot explain 3D protein interactions, but it can be a valuable starting point for a more complex computational and experimental analysis 
653 0 |a Aminokiseline  |a Ligand  |a Receptori  |a Antigeni  |a Bjelančevine  |a Interakcije  |a Molekularno modeliranje  |a Molekularno prepoznavanje  |a Eksperimentalna analiza 
700 1 |a Konjevoda, Paško 
700 1 |a Vikić-Topić, Dražen 
700 1 |a Pokrić, Biserka 
773 0 |t Croatica chemica acta  |x 0011-1643  |g 81 (2008), 2 ; str. 283-287  |w nsk.(HR-ZaNSK)000001621 
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