4NAB
Structure of the (SR)Ca2+-ATPase mutant E309Q in the Ca2-E1-MgAMPPCP form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-02-10 |
| Detector | PSI PILATUS 6M |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 167.010, 55.790, 161.790 |
| Unit cell angles | 90.00, 109.29, 90.00 |
Refinement procedure
| Resolution | 67.007 - 3.500 |
| R-factor | 0.2185 |
| Rwork | 0.216 |
| R-free | 0.26620 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.672 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.8.2_1309)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 70.000 | 3.600 |
| High resolution limit [Å] | 3.500 | 3.500 |
| Number of reflections | 18252 | |
| Completeness [%] | 99.9 | 99.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.8 | 293 | 5.5% PEG6K, 5 mM CaCl2, 15% glycerol, 27 mM MgCl2, 3% MPD, pH 6.8, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
