7Z2X
Wild-type ferulic acid esterase from Lactobacillus buchneri
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-02-15 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.96852 |
Spacegroup name | P 1 |
Unit cell lengths | 47.830, 62.230, 94.850 |
Unit cell angles | 103.05, 101.52, 92.80 |
Refinement procedure
Resolution | 30.934 - 1.500 |
R-factor | 0.1826 |
Rwork | 0.182 |
R-free | 0.21090 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | L. buchneri FAE |
RMSD bond length | 0.005 |
RMSD bond angle | 0.808 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.15.2_3472: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.934 | 1.600 |
High resolution limit [Å] | 1.500 | 1.500 |
Number of reflections | 155659 | 26396 |
<I/σ(I)> | 6.7 | 2.3 |
Completeness [%] | 93.5 | 90 |
Redundancy | 2.8 | |
CC(1/2) | 0.988 | 0.528 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 295 | 0.1 M Bis-Tris pH 5.5, 0.2 M NaCl, 25% P3350 |