Table 1 Data collection and model refinement statistics for luffaculin 1

Cell parameters

a = 39.135 Å, b = 46.813 Å, c = 83.571 Å, α = 89.068°, β = 80.009°, γ = 72.143°

Resolutions (Å)

1.4

Completeness (%)

86.7 (62.0)

Redundancy

1.9 (1.7)

Rmerge (%)^a

0.03 (0.115)

Unique reflections

94795

I/σ(I)

21.8 (4.6)

Resolution range

50.00-1.40 (1.45-1.40)

R_work

0.213 (0.250)

R_free

0.232 (0.275)

No. of water molecules

492

No. of carbohydrates

4 per asymmetric unit

No. of polyethylene glycols

3

R.m.s.deviations from ideal geometry

   Bond lengths (Å)

0.007

   Bond angles (°)

1.153