Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE BW7B |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | BW7B |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2006-03-15 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 0.8423 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 53.505, 94.590, 120.502 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 16.939 - 2.200 |
R-factor | 0.1974 |
Rwork | 0.195 |
R-free | 0.24720 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3KU8 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.082 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.7.3_928)) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 16.940 |
High resolution limit [Å] | 2.131 |
Rmerge | 0.156 |
Number of reflections | 32823 |
<I/σ(I)> | 15 |
Completeness [%] | 100.0 |
Redundancy | 44.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 10 | 293 | 1.2M NAH2PO4, 0.8M K2HPO4, 100MM CAPS, pH 10.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |