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 (%) |
