Figure 9
DEN refinement of Cgl1109 assisted automated model building. (a) The molecular-replacement solution (blue model) is shown together with the final deposited structure (gray; PDB entry 3tx8
). The final refined model (gray) is further superimposed on models obtained by different refinement protocols: (b) DEN refinement (red), (c) simulated-annealing torsion-angle refinement (yellow) and (d) `standard' refinement consisting of 200 steps of positional minimization against Etarget with wDEN = 0 (green). |