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. 2019 Mar 4;8:e43542. doi: 10.7554/eLife.43542

Table 3. Refinement statistics for the TRPV1 system.

CDMD Phenix Rosetta Refmac CDMD (TM domain)
FSCavg (full map) 0.632 0.639 0.626 0.530 0.684
EMRinger 1.28 1.08 0.98 0.348 2.12
Bond lengths (Å) 0.022 0.008 0.021 0.012 0.024
Bond angles (°) 2.14 1.50 2.18 2.81 2.25
MolProbity 1.23 1.90 1.39 3.55 1.50
All-atom clashscore 0.21 8.40 2.03 29.0 0.29
Ramachandran statistics:
Favored (%) 93.37 99.24 93.75 91.29 90.89
Allowed (%) 5.97 0.76 5.26 7.01 7.59
Outliers (%) 0.66 0.0 0.99 1.70 1.52
Poor rotamers (%) 1.95 3.90 0.11 26.9 3.01
CaBLAM flagged (%) 15.9 23.2 20.5 17.9 14.8