2GFI
Crystal structure of the phytase from D. castellii at 2.3 A
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-1 |
Synchrotron site | ESRF |
Beamline | ID14-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-04-18 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.93 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 121.655, 121.655, 332.245 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 65.230 - 2.290 |
Rwork | 0.154 |
R-free | 0.21000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1qfx |
RMSD bond length | 0.015 |
RMSD bond angle | 1.512 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 65.541 | 2.420 |
High resolution limit [Å] | 2.290 | 2.290 |
Rmerge | 0.110 | 0.219 |
Total number of observations | 21949 | |
Number of reflections | 62779 | 7925 |
<I/σ(I)> | 5 | 3.1 |
Completeness [%] | 95.2 | 83 |
Redundancy | 5.1 | 2.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 298 | 0.02M CaCl2 15% MPD, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K |