6N69
rat hPGDS complexed with a quinoline
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E+ |
Temperature [K] | 93 |
Detector technology | IMAGE PLATE |
Collection date | 2010-01-12 |
Detector | RIGAKU RAXIS |
Wavelength(s) | 1.54 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 57.188, 80.997, 97.603 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.290 - 2.000 |
R-factor | 0.18504 |
Rwork | 0.182 |
R-free | 0.23145 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.341 |
Data reduction software | d*TREK |
Data scaling software | d*TREK |
Phasing software | REFMAC |
Refinement software | REFMAC (5.8.0222) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.290 | 2.050 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.075 | 0.405 |
Number of reflections | 29490 | 2022 |
<I/σ(I)> | 9.5 | 2.7 |
Completeness [%] | 99.3 | 94.3 |
Redundancy | 3.48 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 295 | 0.2M NaF, 24.0%w/v PEG 3350 |