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Table 1 Data collection and refinement statistics for the β2-m Trp95Leu variant

From: The two tryptophans of β2-microglobulin have distinct roles in function and folding and might represent two independent responses to evolutionary pressure

 

β2-m Trp95Leu

Beam line

ESRF ID14-1

Space group Unit cell edges (Å, °)

a = 77.41, b = 28.98, c = 54.45, β = 121.7

Resolution (Å)

26.6-1.57

R merge* (%)

5.6 (25.1)

I/σI

17.0 (5.4)

Completeness (%)

99.8 (99.4)

Redundancy

4.4 (4.3)

Unique reflections

14630 (2118)

REFINEMENT

 

R work** (%)

15.2

R free (%)

20.5

Number of atoms

998

Protein

908

Water

72

Ramachandran plot

 

Most favoured region

97.8%

Allowed region

2.2%

  1. Values in parenthesis are for the highest resolution shell.
  2. * R merge = Σ | I - < I > |/Σ | I | where I is the observed intensity and < I > is the average intensity.
  3. ** R work = Σhkl||Fo|-|Fc||/Σhkl|Fo|for all data except 5% which were used for R free calculation.