4GWK
Crystal structure of 6-phosphogluconate dehydrogenase complexed with 3-phosphoglyceric acid
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-F |
Synchrotron site | APS |
Beamline | 21-ID-F |
Temperature [K] | 180 |
Detector technology | CCD |
Collection date | 2011-12-08 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.97857 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 87.246, 87.246, 130.424 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.038 - 1.534 |
R-factor | 0.1706 |
Rwork | 0.170 |
R-free | 0.17450 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3fwn |
RMSD bond length | 0.008 |
RMSD bond angle | 1.337 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASES |
Refinement software | PHENIX ((phenix.refine: 1.7_650)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 72.517 | 2.080 | 1.580 |
High resolution limit [Å] | 1.534 | 1.930 | 1.534 |
Number of reflections | 75680 | ||
Completeness [%] | 99.1 | 100 | 92.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 289 | 14% PEG3350, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 289K |