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. 2020 Dec 22;11:6435. doi: 10.1038/s41467-020-20143-x

Table 2.

Summary of data collection and structural refinement.

E104.v1 Fab:βI-tryptase
PDB code 6VVU
Data collection
 Space group P21
 Cell dimensions
 a, b, c (Å) 89.57, 168.81, 114.65
 α, β, γ (°) 90, 109.97, 90
 Resolution (Å) 50–3.0 (3.112–3.005)
 Rsym or Rmerge 0.098 (0.577)
 II 11.3 (2.1)
 Completeness (%) 97.8 (99.7)
 Redundancy 3.4 (3.5)
Refinement
 Resolution (Å) 50–3.0 (3.112–3.005)
 No. of reflections 62353 (1266)
 Rwork/Rfree 0.187/0.232
 No. of atoms
 Protein 20,689
 Ligand/ion 3
 Water 2
B-factors
 Protein 71.6
 Ligand/ion 48.4
 Water 71.6
R.m.s. deviations
 Bond lengths (Å) 0.01
 Bond angles (°) 1.2

Values in parentheses are for highest-resolution shell.