2GBU
C6A/C111A/C57A/C146A apo CuZn Superoxide dismutase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX II BEAMLINE I711 |
Synchrotron site | MAX II |
Beamline | I711 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-06-20 |
Detector | MARRESEARCH |
Wavelength(s) | 1.092 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 156.614, 34.427, 114.461 |
Unit cell angles | 90.00, 112.17, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.000 |
R-factor | 0.219 |
Rwork | 0.217 |
R-free | 0.25700 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 1hl4 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.061 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | CNS |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.110 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.072 | 0.212 |
Number of reflections | 38835 | |
<I/σ(I)> | 4.4 | |
Completeness [%] | 99.6 | 99 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | 25% PEG4000, 0.1M Na Cacodylate, 50mM NaAc, 1mM EDTA, 1mM NaN3, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K |