Identification and characterization of two drug-like fragments that bind to the same cryptic binding pocket of Burkholderia pseudomallei DsbA

التفاصيل البيبلوغرافية
العنوان: Identification and characterization of two drug-like fragments that bind to the same cryptic binding pocket of Burkholderia pseudomallei DsbA
المؤلفون: Petit Guillaume A., Mohanty Biswarajan, McMahon Róisín., Nebl Stefan, Hilko David H., Wilde Karyn L., Scanlon Martin J., Martin Jennifer L., Halili Maria A.
بيانات النشر: Zenodo
مصطلحات موضوعية: 3. Good health, X-ray crystallography, fragments screening, PanDDA
الوصف: Datasets used to perform the PanDDA analysis presented in the article: "Identification and characterization of two drug-like fragments that bind to the same cryptic binding pocket of Burkholderia pseudomallei DsbA", Acta Crystalllogr D, 2021. Apo (crystal soaked with 5% DMSo)datasets and model are present in the folders with the "APO" prefix. The crystals soaked with ligands are found in the folded with the "LIG" prefix, these folders also contains restraint files for their respective ligands. 
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::5a7fc40bbf9dc5c9528b7a7cb4939fb2
حقوق: OPEN
رقم الأكسشن: edsair.doi...........5a7fc40bbf9dc5c9528b7a7cb4939fb2
قاعدة البيانات: OpenAIRE