EMD-52753

Single-particle
2.67 Å
EMD-52753
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Deposition: 06/02/2025
Map released: 15/10/2025
Last modified: 05/11/2025
Overview 3D View Sample Experiment Validation Additional data Links
Overview 3D View Sample Experiment Validation Additional data Links

EMD-52753
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3D volume (map.gz) Experimental metadata (xml) Experimental Metadata (cif.gz)
Map-only Validation report (pdf.gz) Map-only Validation report (cif.gz) Map-only Validation report (xml.gz)
Map and PDB model 9i96 summary report (pdf.gz) Map and 9i96 FULL report (pdf.gz)
EMICSS annotations (xml)

Cryo-EM structure of Shigella flexneri LptDE bound by a Bicyclic peptide molecule (Compound 5)

EMD-52753

Single-particle
2.67 Å
EMD-52753
3D View Gallery
Deposition: 06/02/2025
Map released: 15/10/2025
Last modified: 05/11/2025
Overview 3D View Sample Experiment Validation Additional data Links
Sample Organism: Shigella flexneri, synthetic construct
Sample: S. flexneri LPS assembly complex LptDE bound to Bicyclic molecule Compound 5
Fitted models: 9i96

Deposition Authors: Allyjaun S, Newman H, Dunbar E, Hardwick SW, Chirgadze DY, van den Berg B, Hubbard J
High-Throughput Identification and Characterization of LptDE-Binding Bicycle Peptides Using Phage Display and Cryo-EM.
Allyjaun S, Dunbar E, Hardwick SW, Newell S, Holding F, Rowland CE, St Denis MA, Pellegrino S, Arruda Bezerra G, Bournakas N, Chirgadze DY, Cooper L, Paris G, Lewis N, Brown P, Skynner MJ, Dawson MJ, Beswick P, Hubbard J, van den Berg B, Newman H
(2025) J Med Chem , 68 , 21144 - 21155
PUBMED: 41048016
DOI: doi:10.1021/acs.jmedchem.5c00307
ISSN: 0022-2623
ASTM: JMCMAR
Grant Support: