5ZIG
The Structure of cellobiose 2-epimerase from Spirochaeta thermophila DSM 6192
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-07-17 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.979460 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 67.530, 205.164, 67.723 |
Unit cell angles | 90.00, 104.26, 90.00 |
Refinement procedure
Resolution | 32.746 - 2.050 |
R-factor | 0.199 |
Rwork | 0.196 |
R-free | 0.26690 |
RMSD bond length | 0.008 |
RMSD bond angle | 0.898 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((1.12_2829)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 102.600 | 2.100 |
High resolution limit [Å] | 2.050 | 2.050 |
Rmerge | 0.042 | 0.381 |
Rmeas | 0.057 | 0.520 |
Number of reflections | 96356 | 6722 |
<I/σ(I)> | 12.94 | 2.11 |
Completeness [%] | 86.5 | 82.2 |
Redundancy | 1.86 | 1.77 |
CC(1/2) | 0.999 | 0.794 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.2M Ca Acetate, 0.1M Bis-Tris-HCl, pH8.5, 20% PEG 3350 |