3BB6
Crystal structure of the P64488 protein from E.coli (strain K12). Northeast Structural Genomics Consortium target ER596
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 | 2007-07-15 |
Detector | ADSC QUANTUM 4 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 68.943, 82.472, 109.924 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.300 |
R-factor | 0.219 |
Rwork | 0.219 |
R-free | 0.26100 |
Structure solution method | SAD |
RMSD bond length | 0.008 |
RMSD bond angle | 1.360 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | SnB |
Refinement software | CNS (1.2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.380 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.090 | 0.536 |
Number of reflections | 51838 | |
<I/σ(I)> | 17.9 | 3.5 |
Completeness [%] | 96.7 | 100 |
Redundancy | 13.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.2 | 293 | PEG 8000, 0.1M NaNO3, 0.1M MES, pH 5.2, VAPOR DIFFUSION, HANGING DROP, temperature 293K |