Molecular modeling of the inhibition of protein-protein interactions with small molecules: The IL2-IL2R alpha case (Articolo in rivista)

Type

• Prodotto della ricerca (Classe)
• Articolo in rivista (Classe)

Label

• Molecular modeling of the inhibition of protein-protein interactions with small molecules: The IL2-IL2R alpha case (Articolo in rivista) (literal)

Anno

• 2011-01-01T00:00:00+01:00 (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#doi

• 10.1016/j.cplett.2011.10.044 (literal)

Alternative label

• Pieraccini, Stefano; De Gonda, Riccardo; Sironi, Maurizio (2011)
  Molecular modeling of the inhibition of protein-protein interactions with small molecules: The IL2-IL2R alpha case
  in Chemical physics letters (Print); North Holland Pub. Co., Amsterdam (Paesi Bassi)
  (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#autori

• Pieraccini, Stefano; De Gonda, Riccardo; Sironi, Maurizio (literal)

Pagina inizio

• 217 (literal)

Pagina fine

• 222 (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#url

• http://www.journals.elsevier.com/chemical-physics-letters/ (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#numeroVolume

• 517 (literal)

Rivista

• Chemical physics letters (Rivista)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#pagineTotali

• 6 (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#numeroFascicolo

• 4-6 (literal)

Note

• ISI Web of Science (WOS) (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#affiliazioni

• University of Milan; University of Milan; Ist Sci & Tecnol Mol CNR CNR ISTM (literal)

Titolo

• Molecular modeling of the inhibition of protein-protein interactions with small molecules: The IL2-IL2R alpha case (literal)

Abstract

• Developing drug like molecules targeting protein-protein interactions is one of the main goals of current medicinal chemistry. To drive the design process it is fundamental to locate those sites on the protein-protein contact surface that are more critical for protein binding, which are the most eligible targets to affect the protein complex formation. In this work we show how computational alanine scanning can be used to identify such critical sites and evaluate their interactions with small molecules designed to inhibit the complex formation. Complex of protein IL2 with IL2R alpha and with some small molecule inhibitors are used as an example. (C) 2011 Elsevier B.V. All rights reserved. (literal)

Editore

• North Holland Pub. Co. (Editore)

Prodotto di

• Nanoingegneria chimica di sistemi assemblati mediante interazioni intermolecolari specifiche (PM.P07.002.002) (Modulo)
• Istituto di scienze e tecnologie molecolari (ISTM) (Istituto)

Autore CNR

• Maurizio Sironi (Persona)
• Stefano Pieraccini (Persona)

Incoming links:

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#rivistaDi

• Chemical physics letters (Rivista)

Prodotto

• Istituto di scienze e tecnologie molecolari (ISTM) (Istituto)
• Nanoingegneria chimica di sistemi assemblati mediante interazioni intermolecolari specifiche (PM.P07.002.002) (Modulo)

Autore CNR di

• Stefano Pieraccini (Persona)
• Maurizio Sironi (Persona)

Editore di

• North Holland Pub. Co. (Editore)