3HBG
Structure of recombinant Chicken Liver Sulfite Oxidase mutant C185S
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-BM |
| Synchrotron site | APS |
| Beamline | 22-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-06-22 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 86.468, 131.517, 98.884 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 27.380 - 1.900 |
| R-factor | 0.17694 |
| Rwork | 0.176 |
| R-free | 0.19565 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | recombinant Chicken liver sulfite oxidase 2A99 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.172 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0088) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 27.380 | 1.970 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Number of reflections | 43889 | |
| <I/σ(I)> | 50.5 | 4.6 |
| Completeness [%] | 98.1 | 85.6 |
| Redundancy | 7.1 | 5.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 291 | 15% (v/v) MPD, 2% PEG 4000 (w/v), and 100 mM Sodium Acetate pH 5.0, VAPOR DIFFUSION, HANGING DROP, temperature 291K |
