3DTB
The structure of rat cytosolic PEPCK in complex with phosphoglycolate and GDP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL11-1 |
Synchrotron site | SSRL |
Beamline | BL11-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-12-04 |
Detector | MARMOSAIC 325 mm CCD |
Wavelength(s) | 0.9 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 62.154, 119.683, 86.849 |
Unit cell angles | 90.00, 107.05, 90.00 |
Refinement procedure
Resolution | 28.830 - 1.300 |
R-factor | 0.169 |
Rwork | 0.168 |
R-free | 0.19300 |
RMSD bond length | 0.013 |
RMSD bond angle | 1.513 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 100.000 | 100.000 | 1.350 |
High resolution limit [Å] | 1.300 | 2.800 | 1.300 |
Rmerge | 0.118 | 0.062 | 0.783 |
Number of reflections | 291304 | ||
<I/σ(I)> | 8.5 | ||
Completeness [%] | 97.9 | 99.4 | 87.4 |
Redundancy | 10.5 | 7.7 | 6.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | hanging drop vapor diffusion | 7.4 | 298 | 12-30% PEG 3350, 0.1M HEPES, 10 MM MNCL2, pH 7.4, hanging drop vapor diffusion, temperature 298K |