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 |
