Table 1.
NFeoB | |
---|---|
Data Collection | |
Wavelength (Å) | 0.9085 |
Resolution range (Å) | 48.12–3.16 (3.272–3.16) |
Space group | P 63 |
Unit cell (Å) | 166.7 166.7 65.6 90 90 120 |
Total reflections | 135770 (12380) |
Unique reflections | 18052 (1753) |
Multiplicity | 7.5 (7.1) |
Completeness (%) | 99.6 (96.3) |
Mean I/sigma (I) | 9.11 (1.39) |
Wilson B-factor (Å2) | 71.34 |
R-merge | 0.2328 (1.384) |
R-meas | 0.2501 |
CC1/2 | 0.992 (0.362) |
CC∗ | 0.998 (0.729) |
Refinement | |
R-work | 0.207 (0.341) |
R-free | 0.238 (0.360) |
Number of nonhydrogen atoms | 3886 |
Protein residues | 509 |
RMS (bonds) | 0.007 |
RMS (angles) | 1.5 |
Ramachandran favored (%) | 97 |
Ramachandran outliers (%) | 0.6 |
Clashscore | 7.01 |
Molprobity Score | 1.77 |
Average B-factor (Å2) | 75.1 |
Values in parentheses represent values for the shell of highest resolution.