Supplementary Materials

Free fatty acid binding pocket in the locked structure of SARS-CoV-2 spike protein

Christine Toelzer, Kapil Gupta, Sathish K. N. Yadav, Ufuk Borucu, Andrew D. Davidson, Maia Kavanagh Williamson, Deborah K. Shoemark, Frederic Garzoni, Oskar Staufer, Rachel Milligan, Julien Capin, Adrian J. Mulholland, Joachim Spatz, Daniel Fitzgerald, Imre Berger, Christiane Schaffitzel

Materials/Methods, Supplementary Text, Tables, Figures, and/or References

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  • Materials and Methods
  • Figs. S1 to S12
  • Tables S1 to S3
  • Captions for Movies S1 to S4
  • References
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Images, Video, and Other Media

Movie S1
Simulation of LA-bound SARS-CoV-2 S trimer colored in cyan, green and pink in the locked conformation, viewed from the side. LA is shown as spheres.
Movie S2
Simulation of SARS-CoV-2 S trimer in the locked form, close up view of LA-bound pocket. LA is shown as spheres. Amino acids interacting with the ligand are shown as sticks.
Movie S3
Simulation of SARS-CoV-2 S trimer colored in cyan, green and pink in the open form, viewed from the side. The RBD of one S monomer (colored in pink) adopts the 'up' position. LA is shown as spheres.
Movie S4
Animated structure of LA-bound SARS-CoV-2 S trimer colored in cyan, green and pink. Morphing of apo S (PDBID 6VXX (7)) to LA-bound S is illustrated.