Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 1999-07-04 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.9798 |
Spacegroup name | P 4 21 2 |
Unit cell lengths | 158.070, 158.070, 81.450 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 33.880 - 2.601 |
R-factor | 0.208 |
Rwork | 0.203 |
R-free | 0.26300 |
Structure solution method | MAD |
RMSD bond length | 0.003 |
RMSD bond angle | 0.669 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | PHENIX ((phenix.refine)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 33.880 | 2.690 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.051 | 0.409 |
Number of reflections | 32178 | |
<I/σ(I)> | 13.2 | |
Completeness [%] | 97.4 | 94 |
Redundancy | 5.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.3 | 294 | PEG400, Ammonium Acetate, Sodium Acetate, EDTA, 2-mercaptoethanol, pH 5.3, VAPOR DIFFUSION, HANGING DROP, temperature 294K |
1 | VAPOR DIFFUSION, HANGING DROP | 5.3 | 294 | PEG400, Ammonium Acetate, Sodium Acetate, EDTA, 2-mercaptoethanol, pH 5.3, VAPOR DIFFUSION, HANGING DROP, temperature 294K |