Skip to main content
. 2007 Aug 10;63(Pt 9):723–727. doi: 10.1107/S1744309107037335

Table 1. Crystallographic data-collection and refinement statistics.

Values in parentheses are for the highest resolution shell.

PDB code 2pm8
Resolution (Å) 50–2.8 (2.9–2.8)
Rmerge (%) 11.6 (52.9)
Completeness (%) 95.0 (95.0)
Redundancy 4.9 (3.0)
I/σ(I) 5.6 (1.6)
Refinement statistics  
R factor (%) 22.5 (30.2)
Rfree§ (%) 29.2 (36.2)
 Mean B factor (Å2) 56.4
 R.m.s. deviation from ideal  
  Bond length (Å) 0.012
  Bond angle (°) 1.536
  Chiral (Å3) 0.101
 Ramachandran plot  
  Most favored regions (%) 80.0
  Additional allowed regions (%) 18.9
  Generously allowed regions (%) 0.5
  Disallowed regions (%) 0.5

R merge = Inline graphic Inline graphic, where I is the observed intensity and 〈I〉 is the average intensity obtained from multiple observations of symmetry-related reflections after rejections.

R factor = Inline graphic Inline graphic, where F o are observed and F c are calculated structure-factor amplitudes.

§

The R free set uses a randomly chosen 5% of reflections.