Table 1 Data collection and refinement statistics

From: Structural basis for the unique ganglioside and cell membrane recognition mechanism of botulinum neurotoxin DC

Data collection

BoNT/DC-HC + Sialyl-T

Space group

P41212

Cell dimensions

 

a, b, c (Å)

109.7, 109.7, 210.5

α, β, γ (°)

90, 90, 90

Resolution (Å)

48.6–2.6 (2.69–2.6)

R merge

0.23 (1.39)

I/σ (I)

13.2 (2.5)

Completeness (%)

99.2 (92.6)

CC(1/2)*

0.99 (0.79)

Redundancy

14.5

Refinement

 

Resolution

48.6–2.6

No. of unique reflections

38,598

R work/R free

0.20/0.23

No. of atoms

 

Protein

6709

Sialyl-T

92

Water

143

B-factors

 

Protein

41

Sialyl-T

66

Water

33

R.m.s. deviations

 

Bond lengths (Å)

0.006

Bond angles (°)

1.18

  1. Values in parenthesis are for the highest resolution shell
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