Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-1 |
Synchrotron site | ESRF |
Beamline | ID14-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC QUANTUM 210 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 143.376, 143.376, 71.886 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 124.030 - 3.200 |
R-factor | 0.249 |
Rwork | 0.245 |
R-free | 0.29400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1tgz |
RMSD bond length | 0.010 |
RMSD bond angle | 1.256 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | CCP4 |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 120.000 | 3.300 |
High resolution limit [Å] | 3.200 | 3.200 |
Rmerge | 0.088 | 0.436 |
Number of reflections | 13469 | |
<I/σ(I)> | 19.6 | 3.3 |
Completeness [%] | 100.0 | 100 |
Redundancy | 8.3 | 8.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5 | pH 5.00 |