3FF1
Structure of Glucose 6-phosphate Isomerase from Staphylococcus aureus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-D |
| Synchrotron site | APS |
| Beamline | 21-ID-D |
| Temperature [K] | 110 |
| Detector technology | CCD |
| Collection date | 2008-10-27 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.97931 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 163.267, 163.267, 103.732 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 46.220 - 1.650 |
| R-factor | 0.148 |
| Rwork | 0.146 |
| R-free | 0.17000 |
| Structure solution method | SAD |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.621 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SHARP |
| Refinement software | REFMAC (5.5.0044) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.710 |
| High resolution limit [Å] | 1.650 | 3.550 | 1.650 |
| Rmerge | 0.108 | 0.083 | 0.401 |
| Number of reflections | 164480 | ||
| <I/σ(I)> | 16.711 | ||
| Completeness [%] | 98.2 | 99.9 | 85.9 |
| Redundancy | 7.7 | 8 | 5.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 298 | 1.4M Sodium Citrate, 0.1M Hepes pH 7.5, 10mM Glucose-6-Phosphate, VAPOR DIFFUSION, temperature 298K |
