Identification of the first small-molecule ligand of the neuronal receptor sortilin and structure determination of the receptor–ligand complex

Andersen, J.L.; Schrøder, T.J.; Christensen, S.; Strandbygård, D.; Pallesen, L.T.; García-Alai, M.M.; Lindberg, S.; Langgård, M.; Eskildsen, J.C.; David, L.; Tagmose, L.; Simonsen, K.B.; Maltas, P.J.; Rønn, L.C.B.; de Jong, I.E.M.; Malik, I.J.; Egebjerg, J.; Karlsson, J.-J.; Uppalanchi, S.; Sakumudi, D.R.; Eradi, P.; Watson, S.P.; Thirup, S.

doi:10.1107/S1399004713030149

Acta Crystallographica Section D
Acta Crystallographica
Section D BIOLOGICAL CRYSTALLOGRAPHY

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Figure 5
Binding mode of AF40431 to sortilin. (a, b) Sortilin is represented as a cartoon in grey and the residues interacting with AF40431 are represented as sticks. C atoms of sortilin, AF40431 and NTS are depicted in grey, orange and purple, respectively, and N and O atoms are depicted in blue and red, respectively. (c) Schematic diagram of hydrogen bonds (black punctured lines) and hydrophobic interactions (grey arches with spokes) between AF40431 and sortilin prepared in LigPlot⁺ (Laskowski & Swindells, 2011

BIOLOGICAL
CRYSTALLOGRAPHY

ISSN: 1399-0047

Volume 70| Part 2| January 2014| Pages 451-460

doi:10.1107/S1399004713030149

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