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Table 2 Data processing and structure refinement statistics for P2-F57A

From: Structure and dynamics of a human myelin protein P2 portal region mutant indicate opening of the β barrel in fatty acid binding proteins

Space group P43212 C2 [26] P212121
Unit cell dimensions a = b = 58.61 Å, c = 76.96 Å α = β = γ = 90° a = 112.76 Å, b = 36.08 Å, c = 31.17 Å, α = γ = 90°, β = 96.87° a = 52.12 Å, b = 76.11 Å, c = 138.43 Å, α = β = γ = 90°
Wavelength (Å) 1.10 1.10 1.10
Resolution range (Å) 20–1.59 (1.63–1.59) 20–1.27 (1.30–1.27) 20–1.95 (2.00–1.95)
<I/σ(I)> 19.1 (1.0) 8.2 (1.2) 11.6 (2.3)
Rsym (%) 6.5 (111.4) 7.6 (60.7) 15.8 (75.0)
Rmeas (%) 7.2 (129.6) 9.2 (78.1) 17.3 (82.1)
Completeness (%) 98.7 (92.7) 96.8 (77.4) 99.1 (98.7)
Redundancy 5.7 (3.2) 2.9 (1.8) 6.0 (6.0)
CC1/2 (%) 99.9 (39.9) 99.6 (43.6) 99.4 (75.4)
Wilson B factor (Å2) 27.2 16.9 20.2
Rcryst (%) 18.6 17.1 18.8
Rfree (%) 21.6 22.4 23.6
rmsd bond lengths (Å) 0.012 0.009 0.005
rmsd bond angles (°) 1.3 1.2 0.9
Ramachandran favoured/allowed (%) 100/100 99.3/100 98.1/100
# molecules in asymmetric unit 1 1 4
MolProbity score (percentile) 1.25 (97th) 1.48 (79th) 1.32 (99th)
PDB entry 6EW2 6EW4 6EW5