3UIY
Crystal structure of SefD_dscA in H2O
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2011-02-14 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9778 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 52.480, 52.480, 218.030 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 45.450 - 3.100 |
R-factor | 0.27027 |
Rwork | 0.268 |
R-free | 0.33151 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2axw |
RMSD bond length | 0.010 |
RMSD bond angle | 1.811 |
Data reduction software | xia2 |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.450 | 3.180 |
High resolution limit [Å] | 3.100 | 3.100 |
Rmerge | 0.072 | 0.443 |
Number of reflections | 3659 | |
<I/σ(I)> | 15.2 | 3.2 |
Completeness [%] | 98.7 | 99.5 |
Redundancy | 4.2 | 4.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 293 | 4 M ammonium acetate, 0.1 M sodium acetate, pH 4.6, VAPOR DIFFUSION, SITTING DROP, temperature 293K |