4LUM
The crystal structure of the P132V mutant of Pyrococcus furiosus phosphoglucose isomerase in complex with manganese and fructose-6- phosphate.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2011-11-04 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.96860 |
Spacegroup name | P 1 |
Unit cell lengths | 44.940, 45.010, 48.690 |
Unit cell angles | 87.81, 89.86, 75.47 |
Refinement procedure
Resolution | 18.490 - 1.790 |
R-factor | 0.17577 |
Rwork | 0.173 |
R-free | 0.22008 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1x7n |
RMSD bond length | 0.009 |
RMSD bond angle | 1.265 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 18.490 | 1.840 |
High resolution limit [Å] | 1.790 | 1.790 |
Rmerge | 0.086 | 0.349 |
Number of reflections | 33074 | |
<I/σ(I)> | 4.3 | 2.2 |
Completeness [%] | 95.7 | 94 |
Redundancy | 1.8 | 1.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 290 | 0.2 M sodium nitrate, 0.1 M Bis Tris Propane PH6.5, 20% PEG4000, VAPOR DIFFUSION, SITTING DROP, temperature 290K |