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. 2014 Nov 24;29(1):99–107. doi: 10.1210/me.2014-1257

Table 1.

Crystallographic Data

Data
Resolution, Å 19.81–2.50
Space group P212121
Unit cell dimensions
    Å 44.0, 137.0, 149.1
    Degrees 90.0, 90.0, 90.0
Rmerge, % 11.0 (62.6)a
Total number of observations 285 221 (32 620)
Total number of unique observations 32 117 (3591)
I/s (I) 7.6 (1.7)
Completeness, % 99.8 (100.0)
Average mosaicity, ° 0.36
*Rwork/Rfree, % 23.5/27.9
Ramachandran plot (favored/allowed/outliers), % 97.4/2.4/0.2
Number of protein residues modeled 846
Number of protein atoms modeled 6478
Number of water molecules modeled 105
Average B factor of protein atoms, Å2 39.4
Average B factor of water molecules, Å2 26.2
Root mean square bond lengths, Å 0.011
Root mean square bond angles, ° 1.491
a

Values in parentheses correspond to the highest-resolution shell.