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4 sample manipulation tasks required in routine crystal screening and data collection. Supplemental ACTOR software for ranking, data collection strategy determination and image processing further increases the value of ACTOR by way of an intelligent framework for automated X-ray diffraction experiments. More recent ACTOR developments incorporate upstream tools used during sample harvesting as well as state of the art sample tracking mechanisms. Additionally, ACTOR software expands downstream to automate structure solution using both ‘bind and grind’ and SAD methods. Altogether these additions function to enhance and expand the protein crystallographer’s toolkit. In this paper we will describe these new hardware and software developments and evaluate their efficacy and reliability for high throughput crystallography.

New insight into catalytic mechanism of serine proteases from ultra-high resolution X-ray studies