3JYN
Crystal structures of Pseudomonas syringae pv. Tomato DC3000 quinone oxidoreductase complexed with NADPH
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2009-04-28 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 63.317, 63.317, 130.374 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 9.960 - 2.010 |
R-factor | 0.20636 |
Rwork | 0.205 |
R-free | 0.23840 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1qor |
RMSD bond length | 0.005 |
RMSD bond angle | 1.088 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 9.960 | 2.080 |
High resolution limit [Å] | 2.010 | 2.010 |
Rmerge | 0.097 | 0.580 |
Number of reflections | 20534 | |
<I/σ(I)> | 22 | 3.33 |
Completeness [%] | 100.0 | 100 |
Redundancy | 7.1 | 7.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 291 | 0.1M Tris-HCl(pH 8.5), 0.2M MgCl2, 30%PEG4000, 12mM NADPH, VAPOR DIFFUSION, SITTING DROP, temperature 291K |