Figure_6.tif (268.61 kB)

The proportion of acceptable poses highly ranked by each of the scoring functions.

Download (0 kB)
figure
posted on 30.11.2011, 02:18 by Lotta Berg, C. David Andersson, Elisabet Artursson, Andreas Hörnberg, Anna-Karin Tunemalm, Anna Linusson, Fredrik Ekström

The percentage of poses with RMSD values less than 2.0 Å compared to the pose found in the crystal structure among the highest ranked (black), among the top five (white) and among the top ten poses (grey) is presented. Since there were few acceptable poses of C5231, the ligand was only considered in the calculation of the percentage among the highest ranked.

History