Marco Basile

Work  /  Publication

Bioinformatics, 2026

A computational analysis of the glycoprotein lipoprotein receptor-related protein 1 structure and the role of glycans as quaternary glue

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Citation

Gian Marco Tuveri, Marco Basile, Silvia Acosta Gutiérrez, Marius Kausas, Silvia Pujals, Xiaohe Tian, Giancarlo Franzese, Lorena Ruiz Pérez, Giuseppe Battaglia

Journal
Bioinformatics
Published
July 2026
Volume
42, issue 7, btag357

In short

LRP1 is one of the main receptors that move cargo, amyloid-β included, across the blood–brain barrier. Yet nobody has solved its structure experimentally.

This paper builds it computationally. Homology modelling and neural-network structure prediction, refined with molecular dynamics, give atomistic models of LRP1 both as a monomer and as a dimer, and suggest how the dimer forms.

The simulations also show the receptor's glycans acting as a quaternary glue: they add contacts between the two halves and stabilise the dimer. The models give testable estimates of LRP1's size, domain layout and interface stability, and are deposited in ModelArchive (ma-k8036, ma-ubwf7).

© The authors, 2026. Open access under CC BY 4.0; shared here unchanged.