4USL
The X-ray structure of calcium bound human sorcin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ELETTRA BEAMLINE 5.2R |
Synchrotron site | ELETTRA |
Beamline | 5.2R |
Temperature [K] | 100 |
Detector technology | PIXEL |
Detector | DECTRIS PILATUS 2M |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 52.369, 111.580, 60.479 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 37.340 - 1.650 |
R-factor | 0.19331 |
Rwork | 0.192 |
R-free | 0.22135 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1juo |
RMSD bond length | 0.010 |
RMSD bond angle | 1.329 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | MOLREP |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.690 |
High resolution limit [Å] | 1.650 | 1.650 |
Rmerge | 0.033 | 0.550 |
Number of reflections | 20590 | |
<I/σ(I)> | 21.57 | 3 |
Completeness [%] | 99.5 | 99.6 |
Redundancy | 3.4 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8.5 | PEG 3350 25% W/V, LISO4 0.5 M, 0.1 M TRIS, PH=8.5, CACL2 0.005M |