4UPG
X-ray structure of calcium-free 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 | I 4 2 2 |
Unit cell lengths | 106.450, 106.450, 77.477 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.590 - 2.100 |
R-factor | 0.18324 |
Rwork | 0.181 |
R-free | 0.21974 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1juo |
RMSD bond length | 0.011 |
RMSD bond angle | 1.462 |
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 | 2.200 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.110 | 0.590 |
Number of reflections | 197835 | |
<I/σ(I)> | 14.82 | 3.61 |
Completeness [%] | 99.7 | 98.2 |
Redundancy | 6.8 | 7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 20% PEG4000, 0.3 M AMMONIUM SULFATE |