5CXR
Influenza endonuclease complexed with 4-bromopyrazole
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CHESS BEAMLINE F1 |
Synchrotron site | CHESS |
Beamline | F1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-03-29 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 0.918 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 87.905, 102.451, 66.062 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.481 - 2.002 |
R-factor | 0.1754 |
Rwork | 0.174 |
R-free | 0.19790 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 0.810 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHENIX |
Refinement software | PHENIX (dev_1988) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.030 |
High resolution limit [Å] | 2.000 | 2.000 |
Number of reflections | 20422 | |
<I/σ(I)> | 26.4 | 2.7 |
Completeness [%] | 99.8 | 100 |
Redundancy | 7.7 | 7.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.7 | 293 | 200 mM MES pH 6.7, 27% PEG8k, 200 mM ammonium sulfate, 10 mM Mg acetate, 10 mM taurine and 50 mM sodium flouride |