2QQW
Crystal structure of a cell-wall invertase (D23A) from Arabidopsis thaliana in complex with sucrose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE BW7A |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | BW7A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-11-22 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1.0332 |
Spacegroup name | P 32 |
Unit cell lengths | 105.877, 105.877, 50.479 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 28.570 - 2.800 |
R-factor | 0.19153 |
Rwork | 0.188 |
R-free | 0.25231 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2ac1 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.333 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.850 |
High resolution limit [Å] | 2.800 | 2.800 |
Number of reflections | 12825 | |
Completeness [%] | 99.4 | 100 |
Redundancy | 3.4 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | 0.1M sodium cacodylate, 0.1M zinc acetate, 22.5% PEG 8000, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |