4OXB
Structure of ECP with sulphate anions at 1.50 Angstroms
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALBA BEAMLINE XALOC |
Synchrotron site | ALBA |
Beamline | XALOC |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-07-10 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9795 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 92.730, 51.286, 55.619 |
Unit cell angles | 90.00, 111.25, 90.00 |
Refinement procedure
Resolution | 44.105 - 1.500 |
R-factor | 0.1818 |
Rwork | 0.179 |
R-free | 0.23150 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.014 |
Refinement software | PHENIX ((phenix.refine: 1.8.4_1496)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.120 | 1.580 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.099 | 0.497 |
Number of reflections | 38779 | |
<I/σ(I)> | 8.3 | 2.4 |
Completeness [%] | 99.3 | 99.3 |
Redundancy | 4.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 289 | Protein resuspended in 20mM sodium cacodylate buffer, pH5.0. 1 uL of protein sample mixed with 1 uL of crystallisation buffer (0.2M lithium sulphate, 0.1M TRIS-HCl pH8.5, 15% PEG4000). |