Skip to main content

Advertisement

Table 1 Data collection and refinement statistics (highest resolution shell in brackets)

From: High resolution structure of cleaved Serpin 42 Da from Drosophila melanogaster

  Spn42Da-1 Spn42Da-2
Data collection statistics   
Beamline Australian Synchrotron MX2 Australian Synchrotron MX2
Oscillation range (°) 1 1
Space group C 2 2 21 I 2 2 2
Cell parameters a = 59.74, b = 125.95, c = 119.94. α = 90, β = 90, γ = 90. a = 87.22, b = 109.77, c = 140.58. α = 90, β = 90, γ = 90.
Resolution Range 27.88- 1.7 (1.79 - 1.7) 40.0 - 1.80 (1.9 - 1.8)
Observed reflections 378728 398398
Unique reflections 50081 (7222) 62423 (8962)
Completeness (%) 99.9 (100.00) 99.6 (98.9)
Rmerge 0.100 (0.672) 0.128 (0.935)
I/σ (I) 12.7 (3.1) 7.3 (1.5)
Refinement statistics   
Resolution range (Å) 27.88 - 1.7 (1.761 - 1.7) 37.06 - 1.80 (1.864 - 1.8)
No. of protein atoms 2927 2946
No. of water atoms 344 377
Rwork/Rfree 0.1651/0.1881 (0.2341/0.2497) 0.1658/0.1854 (0.2774/0.3012)
Rmsd from ideal bond length (Å) 0.006 0.008
angles (°) 1.03 1.09
Ramachandran plot (%)   
Favoured region 99 99
Outlier region 0 0