6S3Z
Structure Of D80A-Fructofuranosidase From Xanthophyllomyces Dendrorhous Complexed With Fructose And hydroquinone
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALBA BEAMLINE XALOC |
Synchrotron site | ALBA |
Beamline | XALOC |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-04-23 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.979460 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 74.559, 205.949, 146.162 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.610 - 1.850 |
R-factor | 0.16142 |
Rwork | 0.160 |
R-free | 0.18035 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 5ann |
RMSD bond length | 0.012 |
RMSD bond angle | 1.776 |
Data reduction software | XDS (0.72) |
Data scaling software | Aimless (0.5.26) |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.760 | 1.880 |
High resolution limit [Å] | 1.850 | 1.850 |
Rmerge | 0.069 | 0.587 |
Rpim | 0.028 | 0.241 |
Number of reflections | 192124 | 9418 |
<I/σ(I)> | 16.4 | 3.3 |
Completeness [%] | 100.0 | 100 |
Redundancy | 6.8 | 6.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291 | 1.2 M Sodium Citrate tribasic dihydrate, then soaked in 20mM fructose plus 50 mM hydroquinone |