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, Continuous c(s) B and 1 µL of reservoir solution at 19 °C. Commercial screens (Morpheus I and II, Clear Strategy Screen I and II and BCS; Molecular Dimensions Ltd) led to several crystallization hits. Cocrystallisation with 20 mM MeFuc using the solution 1-40 from Morpheus 1 (Gorrec, 2009) (120 mM alcohols, Sedimentation velocity experiments were conducted in titanium double-sector centerpiece cells (Nanolytics Instruments, Germany) buffer composition, respectively, using the software Sednterp, p.3350, 2000.
, 35% PEG smear medium, 10% isopropanol optimized from hit from solution 2-38 of the BCS screen, 2005.
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5% of the observations were set aside for cross-validation analysis and riding hydrogen atoms were added and used for geometry and structure-factor calculations. The stereochemical quality of the refined models was validated on the wwPDB Validation server: http://wwpdbvalidation.wwpdb.org and carbohydrates were checked in Privateer, Structural determination and refinement. The structure of KozL was solved by SAD method at the selenium peak (? = 0.97914 Å) using the signal of the selenated ligand. ShelXC/D (Schneider and Sheldrick, vol.8, 2002. ,
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Structural basis of specific recognition of non-reducing terminal N-acetylglucosamine by an Agrocybe aegerita Lectin, PLoS One, vol.10, p.129608, 2015. ,
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