1X82
CRYSTAL STRUCTURE OF PHOSPHOGLUCOSE ISOMERASE FROM PYROCOCCUS FURIOSUS WITH BOUND 5-phospho-D-arabinonate
Replaces: 1PLZExperimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2003-07-25 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.89843 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 84.506, 42.730, 57.308 |
| Unit cell angles | 90.00, 120.32, 90.00 |
Refinement procedure
| Resolution | 20.000 - 1.500 |
| R-factor | 0.16301 |
| Rwork | 0.161 |
| R-free | 0.20821 |
| Structure solution method | SAD |
| Starting model (for MR) | 1PLZ |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.232 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 21.000 | 1.530 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.054 | 0.314 |
| Number of reflections | 26896 | |
| <I/σ(I)> | 30 | 1.85 |
| Completeness [%] | 94.5 | 90.6 |
| Redundancy | 3.5 | 1.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 290 | 1.6M tri-sodium citrate, 50mM 5-phospho-D-arabinonate, 100mM MnCl2, pH 6.50, VAPOR DIFFUSION, HANGING DROP, temperature 290K |
