4AS7
Eg5 complex 1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 277 |
Collection date | 2011-01-20 |
Spacegroup name | P 65 |
Unit cell lengths | 81.070, 81.070, 123.961 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 28.936 - 2.400 |
R-factor | 0.1616 |
Rwork | 0.159 |
R-free | 0.21240 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1x88 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.627 |
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 | 2.500 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.090 | 0.360 |
Number of reflections | 10595 | |
<I/σ(I)> | 14.8 | 5.6 |
Completeness [%] | 98.3 | 98.9 |
Redundancy | 7.5 | 7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 0.02 M CACL2 DEHYDRATE, 0.02 M CADMIUM CHLORIDE HYDRATE, 0.02 M COBALT(II) CHLORIDE HEXAHYDRATE, 20% W/V PEG-3350 |