Table 1 Data collection and refinement statistics.
From: An archaeal lid-containing feruloyl esterase degrades polyethylene terephthalate
PET46 | |
PDB ID | 8B4U |
Data collection | |
Wavelength [Å] | 0.9793 |
Space group | P6122 |
Unit Cell Parameters | |
a, b, c [Å] | 79.29 79.29 171.55 |
α, β, γ [°] | 90.00 90.00 120.00 |
Resolution [Å] | 68.67–1.71 (1.74–1.71) |
Number of unique reflections | 34,960 (1,813) |
Rmerge | 0.066 (1.370) |
Rmeas | 0.071 (1.457) |
Rpim | 0.024 (0.487) |
<I/σ(I)> | 15.7 (1.5) |
CC1/2 | 0.999 (0.559) |
Completeness [%] | 99.4 (99.9) |
Multiplicity | 8.5 (8.5) |
Refinement | |
Resolution [Å] | 38.68–1.71 |
Number of reflections | 34953 |
Rwork/Rfree [%] | 15.2 / 17.3 |
MolProbity overall score | 1.24 |
R.M.S. deviations | |
bond length [Å] | 0.011 |
bond angles [°] | 1.013 |
Ramachandran plot | |
Favored [%] | 98.88 |
Allowed [%] | 1.12 |
Outliers [%] | 0 |
