4S2W
Structure of E. coli RppH bound to sulfate ions
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2013-05-17 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 78.391, 38.851, 56.806 |
Unit cell angles | 90.00, 98.95, 90.00 |
Refinement procedure
Resolution | 19.425 - 1.992 |
R-factor | 0.1724 |
Rwork | 0.170 |
R-free | 0.21550 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.098 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHENIX |
Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.110 |
High resolution limit [Å] | 1.992 | 2.000 |
Rmerge | 0.090 | 0.523 |
Number of reflections | 10978 | |
<I/σ(I)> | 2.87 | |
Completeness [%] | 93.2 | 84.7 |
Redundancy | 4.9 | 4.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 295 | 0.4 M ammonium sulfate, 12% PEG 3350, 10% glycerol, VAPOR DIFFUSION, HANGING DROP, temperature 295K |