Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
Synchrotron site | Photon Factory |
Beamline | AR-NW12A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-06-10 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.0 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 163.569, 82.893, 180.834 |
Unit cell angles | 90.00, 91.50, 90.00 |
Refinement procedure
Resolution | 41.070 - 2.000 |
R-factor | 0.21 |
Rwork | 0.209 |
R-free | 0.23417 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2zqz |
RMSD bond length | 0.018 |
RMSD bond angle | 1.780 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.030 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.046 | 0.589 |
Number of reflections | 160457 | 8179 |
<I/σ(I)> | 27.6 | 1.7 |
Completeness [%] | 97.1 | 99.3 |
Redundancy | 3.6 | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.4 | 298 | 100mM sodium citrate, 200mM potassium sodium tartrate, 1.6M ammonium sulfate |