Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.1 |
Synchrotron site | ALS |
Beamline | 8.2.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-11-22 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.282 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 40.245, 58.427, 104.825 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.015 - 1.653 |
R-factor | 0.1466 |
Rwork | 0.144 |
R-free | 0.18330 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1azv |
RMSD bond length | 0.005 |
RMSD bond angle | 0.913 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | PHENIX ((phenix.refine: 1.7_650)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.710 |
High resolution limit [Å] | 1.650 | 1.650 |
Number of reflections | 30227 | |
<I/σ(I)> | 23.2 | 5.5 |
Completeness [%] | 99.9 | 99.5 |
Redundancy | 7.2 | 6.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 2.3 M AMMONIUM SULFATE, 0.1 M TRIS, TEMPERATURE 298K, pH 8.0, VAPOR DIFFUSION, HANGING DROP |