1T5T
Structure of the (SR)Ca2+-ATPase Ca2-E1-ADP:AlF4- form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-02-24 |
Detector | MARRESEARCH |
Wavelength(s) | 0.952 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 162.477, 75.617, 151.651 |
Unit cell angles | 90.00, 108.82, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.900 |
R-factor | 0.24746 |
Rwork | 0.246 |
R-free | 0.29348 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.571 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | REFMAC (5.1.9999) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.970 |
High resolution limit [Å] | 2.900 | 2.900 |
Rmerge | 0.110 | 0.800 |
Number of reflections | 38895 | |
<I/σ(I)> | 23.9 | 2.1 |
Completeness [%] | 99.9 | 99.8 |
Redundancy | 7.3 | 5.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.8 | 292 | PEG 6000, tert-butanol, sodium acetate, potassium chloride, magnesium chloride, glycerol, MOPS, pH 6.8, VAPOR DIFFUSION, HANGING DROP, temperature 292K |
1 | VAPOR DIFFUSION, HANGING DROP | 6.8 | 292 | PEG 6000, tert-butanol, sodium acetate, potassium chloride, magnesium chloride, glycerol, MOPS, pH 6.8, VAPOR DIFFUSION, HANGING DROP, temperature 292K |
1 | VAPOR DIFFUSION, HANGING DROP | 6.8 | 292 | PEG 6000, tert-butanol, sodium acetate, potassium chloride, magnesium chloride, glycerol, MOPS, pH 6.8, VAPOR DIFFUSION, HANGING DROP, temperature 292K |