4A1Z
Eg5-1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I02 |
Synchrotron site | Diamond |
Beamline | I02 |
Temperature [K] | 298 |
Detector technology | CCD |
Detector | ADSC CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 51.484, 78.390, 93.265 |
Unit cell angles | 90.00, 93.47, 90.00 |
Refinement procedure
Resolution | 29.232 - 2.800 |
R-factor | 0.1776 |
Rwork | 0.173 |
R-free | 0.25740 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ii6 |
RMSD bond length | 0.012 |
RMSD bond angle | 1.535 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.950 |
High resolution limit [Å] | 2.800 | 2.800 |
Rmerge | 0.140 | 0.500 |
Number of reflections | 18414 | |
<I/σ(I)> | 12.7 | 4.6 |
Completeness [%] | 99.9 | 100 |
Redundancy | 3.3 | 4.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.8 | 14% PEG 3350 0.2 M NA NO3 0.1 M MES (PH 5.6). |