Partial-occupancy binders identified by the Pan-Dataset Density Analysis method offer new chemical opportunities and reveal cryptic binding sites

Crystallographic fragment screening uses low molecular weight compounds to probe the protein surface and although individual protein-fragment interactions are high quality, fragments commonly bind at low occupancy, historically making identification difficult. However, our new Pan-Dataset Density An...

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Bibliographic Details
Published in:Struct Dyn
Main Authors: Pearce, Nicholas M., Bradley, Anthony R., Krojer, Tobias, Marsden, Brian D., Deane, Charlotte M., von Delft, Frank
Format: Artigo
Language:Inglês
Published: American Crystallographic Association 2017
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Transactions from the 66th Annual Meeting of the American Crystallographic Association (Aca)
Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC5336473/
https://ncbi.nlm.nih.gov/pubmed/28345007
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.4974176
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