Ligand binding analysis for human α5β1 integrin: Strategies for designing new α5β1 integrin antagonists

Luciana Marinelli; Axel Meyer; Dominik Heckmann; Antonio Lavecchia; Ettore Novellino; Horst Kessler

doi:10.1021/jm040224i

Ligand binding analysis for human α5β1 integrin: Strategies for designing new α5β1 integrin antagonists

Luciana Marinelli, Axel Meyer, Dominik Heckmann, Antonio Lavecchia, Ettore Novellino, Horst Kessler

TUM Emeriti of Excellence

Research output: Contribution to journal › Article › peer-review

69 Scopus citations

Abstract

We report a three-dimensional model of the α5β1 integrin headgroup bound to the most potent and selective ligand (SJ749) known to date. The model was built using the comparative protein modeling method, and it is consistent with experimental data. From this study, we identified two potentially important regions in the α5β1 receptor that are peculiar to this integrin and might be worth considering for drug targeting.

Original language	English
Pages (from-to)	4204-4207
Number of pages	4
Journal	Journal of Medicinal Chemistry
Volume	48
Issue number	13
DOIs	https://doi.org/10.1021/jm040224i
State	Published - 30 Jun 2005

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abstract = "We report a three-dimensional model of the α5β1 integrin headgroup bound to the most potent and selective ligand (SJ749) known to date. The model was built using the comparative protein modeling method, and it is consistent with experimental data. From this study, we identified two potentially important regions in the α5β1 receptor that are peculiar to this integrin and might be worth considering for drug targeting.",

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AU - Heckmann, Dominik

AU - Lavecchia, Antonio

AU - Novellino, Ettore

AU - Kessler, Horst

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AB - We report a three-dimensional model of the α5β1 integrin headgroup bound to the most potent and selective ligand (SJ749) known to date. The model was built using the comparative protein modeling method, and it is consistent with experimental data. From this study, we identified two potentially important regions in the α5β1 receptor that are peculiar to this integrin and might be worth considering for drug targeting.

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Ligand binding analysis for human α5β1 integrin: Strategies for designing new α5β1 integrin antagonists

Abstract

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