1IB5
X-RAY 3D STRUCTURE OF P.LEIOGNATHI CU,ZN SOD MUTANT W83Y
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RUH3R |
Temperature [K] | 298 |
Detector technology | IMAGE PLATE |
Collection date | 1999-04-11 |
Detector | MARRESEARCH |
Wavelength(s) | 1.54 |
Spacegroup name | H 3 2 |
Unit cell lengths | 87.336, 87.336, 98.223 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 20.000 - 2.450 |
R-factor | 0.216 |
Rwork | 0.216 |
R-free | 0.26500 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | P.leiognathi Cu Zn SOD wild type |
RMSD bond length | 0.006 |
RMSD bond angle | 1.320 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 20.000 |
High resolution limit [Å] | 2.450 |
Rmerge | 0.230 |
Total number of observations | 33184 * |
Number of reflections | 5289 |
<I/σ(I)> | 5 |
Completeness [%] | 97.0 |
Redundancy | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | unknown * | 4.5 | 100 * | PEG 8k, NaCl, pH 4.5, VAPOR DIFFUSION, HANGING DROP, temperature 301K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | 1 | PEG8000 | 30 (%) | |
2 | 1 | 1 | 0.1 (M) | ||
3 | 1 | 1 | sodium acetate | 0.05 (M) | |
4 | 1 | 1 | glycerol | 10 (%) |