4B0Y
Determination of X-ray Structure of human SOUL by Molecular Replacement
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-09-07 |
Detector | ADSC QUANTUM 4 |
Spacegroup name | P 64 2 2 |
Unit cell lengths | 144.670, 144.670, 60.190 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 47.350 - 3.500 |
R-factor | 0.2739 |
Rwork | 0.270 |
R-free | 0.30638 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4ayz |
RMSD bond length | 0.005 |
RMSD bond angle | 0.846 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.350 | 3.690 |
High resolution limit [Å] | 3.500 | 3.500 |
Rmerge | 0.150 | 0.750 |
Number of reflections | 5025 | |
<I/σ(I)> | 24.6 | 6.2 |
Completeness [%] | 100.0 | 100 |
Redundancy | 30.8 | 32.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 2 M AMMONIUM SULPHATE, 0.1 M MES 6.5 |