Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-05-12 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.979 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 74.030, 74.030, 131.950 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 36.269 - 2.140 |
R-factor | 0.1926 |
Rwork | 0.191 |
R-free | 0.23960 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 0.991 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER (2.1.4) |
Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 40.000 | 4.760 | 1.690 |
High resolution limit [Å] | 1.590 | 3.380 | 1.590 |
Rmerge | 0.109 | 0.079 | 0.079 |
Number of reflections | 23369 | 3892 | 7520 |
<I/σ(I)> | 8.93 | 35.88 | 0.21 |
Completeness [%] | 95.6 | 99.1 | 83.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 19-20%(w/v)PEG 3350, 200mM MgSO4, 100mM Tris-HCl, pH 7.5, vapor diffusion, hanging drop, temperature 293K |