Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX II BEAMLINE I911-5 |
Synchrotron site | MAX II |
Beamline | I911-5 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-05-08 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.908 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 160.350, 88.540, 136.760 |
Unit cell angles | 90.00, 95.99, 90.00 |
Refinement procedure
Resolution | 19.950 - 1.700 |
R-factor | 0.2358 |
Rwork | 0.235 |
R-free | 0.29200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1rts |
RMSD bond length | 0.022 |
RMSD bond angle | 1.956 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER (1.3.3) |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 20.000 | 20.000 | 1.730 |
High resolution limit [Å] | 1.700 | 4.600 | 1.700 |
Rmerge | 0.063 | 0.047 | 0.993 |
Number of reflections | 207806 | ||
<I/σ(I)> | 16.9 | ||
Completeness [%] | 99.9 | 99.5 | 100 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 278 | K/Na Tartrate, PEG 3350, VAPOR DIFFUSION, HANGING DROP, temperature 278K |