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Table 1 Data collection and refinement statistics

From: Conformational flexibility and molecular interactions of an archaeal homologue of the Shwachman-Bodian-Diamond syndrome protein

Data collection  
Space group P2221
Unit cell, Å a = 68.3, b = 72.1, c = 146.8; α = β = γ = 90°
Resolution (outer shell), Å1 30.0–1.75 (1.75 – 1.78)
Wavelength, Å 1.0081
Completeness, % 98.4 (82.8)
Multiplicity 3.9 (3.0)
Unique reflections 72600 (3002)
<I>/s(I) 20.3 (1.7)
Rmerge2 (%) 6.3 (58.9)
Wilson B factor (Å2) 25
Refinement  
R-factor3/Free R-factor (%) 19.1/21.4
r.m.s.d.4 bonds/angles (Å,°) 0.010 (0.022)/1.173 (1.982)
Average B (Å2) 37.1
  1. 1Values in parenthesis are for the highest resolution shell.
  2. 2The value of the merging R factor between equivalent measurements of the same reflection, R = ΣhklΣj|Ihkl, j - <Ihkl>|/ΣhklΣj Ihkl, j.
  3. 3Crystallographic R-factor, R(free) = Σ ||Fo| - |Fc||/Σ |Fo|.
  4. 4R.m.s. deviation from the standard values are given with target values in parentheses.