Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 32-ID |
Synchrotron site | APS |
Beamline | 32-ID |
Temperature [K] | 99.8 |
Detector technology | CCD |
Collection date | 2004-06-24 |
Detector | MARRESEARCH |
Wavelength(s) | 0.9792 |
Spacegroup name | P 1 |
Unit cell lengths | 51.940, 53.560, 53.480 |
Unit cell angles | 65.88, 70.37, 70.88 |
Refinement procedure
Resolution | 25.000 - 2.090 |
R-factor | 0.21609 |
Rwork | 0.210 |
R-free | 0.27655 |
Structure solution method | SAD |
RMSD bond length | 0.014 |
RMSD bond angle | 1.474 |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | REFMAC (5.1.24) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.180 |
High resolution limit [Å] | 2.090 | 2.090 |
Rmerge | 0.109 | 0.270 |
Number of reflections | 26115 | |
<I/σ(I)> | 12.4 | 2.6 |
Completeness [%] | 92.2 | 73 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 295 | PEG, pH 8, VAPOR DIFFUSION, SITTING DROP, temperature 295K |