Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-BM |
Synchrotron site | APS |
Beamline | 22-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-04-22 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.00 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 100.161, 100.161, 97.801 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 43.370 - 1.400 |
R-factor | 0.11 |
Rwork | 0.109 |
R-free | 0.14000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ude |
RMSD bond length | 0.006 |
RMSD bond angle | 0.843 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX ((1.11.1_2575)) |
Refinement software | PHENIX ((1.11.1_2575)) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 44.500 |
High resolution limit [Å] | 1.270 |
Rmerge | 0.064 |
Number of reflections | 116219 |
<I/σ(I)> | 13.4 |
Completeness [%] | 96.3 |
Redundancy | 8.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 298 | Tris, MPD, Calcium Chloride, Sodium Pyrophosphate |