3LAA
Crystal structure of the trimeric autotransporter adhesin head domain BpaA from Burkholderia pseudomallei
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.3 |
Synchrotron site | ALS |
Beamline | 5.0.3 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-10-25 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.5418 |
Spacegroup name | H 3 |
Unit cell lengths | 50.718, 50.718, 136.496 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 45.500 - 1.350 |
R-factor | 0.115 |
Rwork | 0.114 |
R-free | 0.12800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3la9 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.116 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.370 |
High resolution limit [Å] | 1.350 | 1.350 |
Rmerge | 0.075 | 0.399 |
Number of reflections | 28462 | |
<I/σ(I)> | 16.5 | 2.14 |
Completeness [%] | 98.9 | 81.7 |
Redundancy | 4.9 | 2.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 289 | JCSG+ C12, 10% PEG 1000, 10% PEG 8000, crystal tracking ID 203139c12, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 289K |