Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08B1-1 |
Synchrotron site | CLSI |
Beamline | 08B1-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-02-05 |
Detector | RAYONIX MX300HE |
Wavelength(s) | 0.9793 |
Spacegroup name | H 3 |
Unit cell lengths | 259.360, 259.360, 71.810 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 49.010 - 2.100 |
R-factor | 0.19215 |
Rwork | 0.191 |
R-free | 0.20637 |
Structure solution method | SAD |
RMSD bond length | 0.005 |
RMSD bond angle | 1.006 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHENIX |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.010 | 2.154 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.868 | |
Number of reflections | 104643 | |
<I/σ(I)> | 12.22 | 2.33 |
Completeness [%] | 99.5 | 95.32 |
Redundancy | 10.7 | 6.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 0.01 M HEPES, pH 7.5, 0.26 M sodium potassium tartrate, 20% PEG3350, VAPOR DIFFUSION, HANGING DROP, temperature 297K, temperature 298K |