Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.3.1 |
Synchrotron site | ALS |
Beamline | 8.3.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-10-15 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.115870 |
Spacegroup name | P 4 21 2 |
Unit cell lengths | 110.531, 110.531, 53.390 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 25.260 - 2.240 |
R-factor | 0.24 |
Rwork | 0.240 |
R-free | 0.30300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1j4n |
RMSD bond length | 0.006 |
RMSD bond angle | 1.200 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.041 | 0.500 |
Number of reflections | 16284 | |
<I/σ(I)> | 27.96 | 2.6 |
Completeness [%] | 93.7 | 80 |
Redundancy | 20.3 | 5.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 10 | 298 | 30% polyethylene glycol 1000, 20 mM glycine, 50 mM NaCl, pH 10.00, VAPOR DIFFUSION, SITTING DROP, temperature 298K |