Table 1 Data collection and refinement statistics (molecular replacement)

From: Generation and characterization of neutralizing antibodies against M1R and B6R proteins of monkeypox virus

 

M1R-A129 Fab complex

M1R-A138 Fab complex

Data collection

Space group

P212121

P21

Cell dimensions

 a, b, c (Å)

74.7, 89.3, 100.7

82.4, 136.7, 123.8

 α, β, γ (°)

90.0, 90.0, 90.0

90.0, 96.5, 90.0

 Resolution (Å)

50.37-2.17 (2.25-2.17)

50.00-3.49 (3.62-3.49)

 Rsym or Rmerge

0.117 (1.267)

0.253 (0.779)

 I / σI

15.9 (2.0)

5.4 (1.6)

 Completeness (%)

99.91 (99.97)

97.31 (87.41)

 Redundancy

12.7 (11.6)

5.2 (4.6)

Refinement

 Resolution (Å)

38.33-2.17 (2.25-2.17)

46.67-3.49 (3.62-3.49)

 No. reflections

36315 (3566)

33838 (3041)

 Rwork / Rfree

0.231/0.251

0.236/0.282

No. atoms

 Protein

4566

17614

 Ligand/ion

167

0

B-factor

 Protein

50

73

 Ligand/ion

47

 

RMSD

 Bond lengths (Å)

0.015

0.007

 Bond angles (°)

1.88

1.26

Ramachandran Plot

 Favored (%)

97.32

96.14

 Allowed (%)

2.68

3.77

 Outliers (%)

0

0.09

  1. Values in parentheses are for the highest-resolution shell
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