5JE6
Crystal structure of Burkholderia glumae ToxA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CHESS BEAMLINE A1 |
Synchrotron site | CHESS |
Beamline | A1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-10-09 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.977 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 152.992, 56.424, 60.831 |
Unit cell angles | 90.00, 91.32, 90.00 |
Refinement procedure
Resolution | 19.400 - 1.571 |
R-factor | 0.1491 |
Rwork | 0.147 |
R-free | 0.17890 |
Structure solution method | SAD |
RMSD bond length | 0.016 |
RMSD bond angle | 1.414 |
Data reduction software | XDS |
Data scaling software | HKL-2000 |
Phasing software | SHELXCD |
Refinement software | PHENIX ((1.10-2155-000)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.400 | 1.630 |
High resolution limit [Å] | 1.570 | 1.570 |
Rmerge | 0.027 | 0.215 |
Number of reflections | 69075 | |
<I/σ(I)> | 21.5 | 4.3 |
Completeness [%] | 95.6 | 89.3 |
Redundancy | 3.4 | 2.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 291 | 19% polyethylene glycol 3000 and 100 mM sodium citrate, pH 5.5 |