Table 2 Data collection and refinement statistics (molecular replacement)

 Space group

C2 ₁

 Cell dimensions

  a, b, c (Å)

118.2, 38.7, 108.5

  α, β, γ (°)

90.0, 116.7, 90.0

 Resolution (Å)

48.5–1.95 (2.00–1.95)^a

 R_merge

0.097 (0.73)^a

 I/σI

8.3 (1.6)^a

 Completeness (%)

96.9 (94.4)^a

 Redundancy

3.5 (3.3)^a

 Resolution (Å)

48.5–1.95

 No. of reflections

29,725

 R_work/R_free

17.8/20.9

 No. atoms

  Protein

3510

  Ligand/ion

11

  Water

257

 B-factors

  Protein

35.2

  Ligand/ion

61.5

  Water

42.1

 R.m.s. deviations

  Bond lengths (Å)

0.008

  Bond angles (°)

1.20