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Predicting the three-dimensional structure of human P-glycoprotein in absence of ATP by computational techniques embodying crosslinking data: insight into the mechanism of ligand migration and binding sites.

par Vandevuer, Stéphane ;Van Bambeke, Françoise;Tulkens, Paul M.;Prévost, Martine
Référence Proteins, 63, 3, page (466-478)
Publication Publié, 2006-05

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Titre:	Predicting the three-dimensional structure of human P-glycoprotein in absence of ATP by computational techniques embodying crosslinking data: insight into the mechanism of ligand migration and binding sites.
Auteur:	Vandevuer, Stéphane; Van Bambeke, Françoise; Tulkens, Paul M.; Prévost, Martine
Informations sur la publication:	Proteins, 63, 3, page (466-478)
Statut de publication:	Publié, 2006-05
Sujet CREF:	Chimie
Mots-clés:	ABC transporters
	Computer-assisted molecular modeling
	Drug transport
	Membrane proteins
	Multidrug resistance
	P-gp
MeSH keywords:	Adenosine Triphosphate -- chemistry
	Adenosine Triphosphate -- genetics
	Amino Acid Sequence
	Binding Sites
	Computational Biology -- methods
	Cross-Linking Reagents -- chemistry
	Escherichia coli Proteins -- chemistry
	Escherichia coli Proteins -- genetics
	Forecasting
	Humans
	Image Processing, Computer-Assisted -- methods
	Ligands
	Models, Structural
	Molecular Sequence Data
	P-Glycoprotein -- chemistry
	P-Glycoprotein -- genetics
	P-Glycoprotein -- metabolism
	Protein Binding
	Protein Structure, Tertiary
Note générale:	Journal Article
	Research Support, Non-U.S. Gov't
	SCOPUS: ar.j
	FLWIN
Langue:	Anglais
Identificateurs:	urn:issn:0887-3585
	info:doi/10.1002/prot.20892
	info:scp/33646029725
	info:pmid/16463278