Figure 6
ARCIMBOLDO_BORGES implementation. The scheme summarizes the steps in the procedure. PHASER operations are printed in blue and SHELXE ones on a blue background. BORGES operations are printed in red. Starting from a model template, a library of equivalent folds is created and geometrically clustered. For each cluster, a rotation search is calculated at 2 Å. Models are dissembled and locally optimized in P1 with PHASER. Peaks are clustered geometrically, within a tolerance of 15°. Fragment location and density modification and autotracing is pursued for each model. |