3NHV
Crystal Structure of BH2092 protein from Bacillus halodurans, Northeast Structural Genomics Consortium Target BhR228F
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X4C |
Synchrotron site | NSLS |
Beamline | X4C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-06-05 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.97877 |
Spacegroup name | P 21 3 |
Unit cell lengths | 145.873, 145.873, 145.873 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.850 - 2.500 |
R-factor | 0.199 |
Rwork | 0.195 |
R-free | 0.24700 |
Structure solution method | SAD |
RMSD bond length | 0.007 |
RMSD bond angle | 1.100 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELX |
Refinement software | CNS (1.2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.520 |
High resolution limit [Å] | 2.430 | 2.430 |
Rmerge | 0.070 | 0.443 |
Number of reflections | 73851 | |
<I/σ(I)> | 34.97 | 3.5 |
Completeness [%] | 97.4 | 76.5 |
Redundancy | 6.1 | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | microbatch, under oil | 6 | 291 | Protein solution: 100mM NaCl, 5mM DTT, 0.02% NaN3, 10mM Tris-HCl (pH 7.5) . Reservoir solution: 0.1M MES (pH 6), 40% PEG400, and 0.1M potassium chloride. , microbatch, under oil, temperature 291K |