Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-04-16 |
Detector | ADSC CCD |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 170.500, 170.500, 100.651 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 147.660 - 2.810 |
R-factor | 0.24782 |
Rwork | 0.246 |
R-free | 0.28425 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3hmi |
RMSD bond length | 0.011 |
RMSD bond angle | 1.345 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0110) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 41.140 | 2.960 |
High resolution limit [Å] | 2.810 | 2.810 |
Rmerge | 0.100 | 1.020 |
Number of reflections | 41549 | |
<I/σ(I)> | 10.8 | 1.9 |
Completeness [%] | 99.9 | 100 |
Redundancy | 7.3 | 7.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 277 | 0.8M SODIUM SUCCINATE, PH 7, VAPOUR DIFFUSION, SITTING DROP, TEMPERATURE 277K |