3LV4
Crystal structure of the glycoside hydrolase, family 43 YxiA protein from Bacillus licheniformis. Northeast Structural Genomics Consortium Target BiR14.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X4A |
Synchrotron site | NSLS |
Beamline | X4A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-02-15 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.97918 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 210.585, 60.327, 73.122 |
Unit cell angles | 90.00, 97.47, 90.00 |
Refinement procedure
Resolution | 45.244 - 1.695 |
R-factor | 0.1486 |
Rwork | 0.146 |
R-free | 0.19030 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.056 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SHELXDE |
Refinement software | PHENIX ((phenix.refine: 1.5_2)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 500.000 | 1.760 |
High resolution limit [Å] | 1.695 | 1.700 |
Rmerge | 0.092 | 0.528 |
Number of reflections | 192259 | |
<I/σ(I)> | 15.2 | 2.2 |
Completeness [%] | 97.3 | 92.1 |
Redundancy | 3.2 | 2.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.15 | 291 | 18% PEG 3350, 0.2M Ca acetate, 0.1M MES, pH 6.15, VAPOR DIFFUSION, HANGING DROP, temperature 291K |