3TRC
Structure of the GAF domain from a phosphoenolpyruvate-protein phosphotransferase (ptsP) from Coxiella burnetii
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-06-28 |
Detector | RIGAKU SATURN 944 |
Wavelength(s) | 1.5418 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 54.869, 54.869, 105.256 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 31.229 - 1.650 |
R-factor | 0.1869 |
Rwork | 0.185 |
R-free | 0.21440 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.005 |
RMSD bond angle | 0.933 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX (1.7_650) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.680 |
High resolution limit [Å] | 1.650 | 4.480 | 1.650 |
Rmerge | 0.051 | 0.042 | 0.351 |
Number of reflections | 19760 | ||
<I/σ(I)> | 13.9 | ||
Completeness [%] | 98.3 | 99.4 | 91.4 |
Redundancy | 7.9 | 14.6 | 2.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 295 | 0.1M HEPES pH 7.5, 1.4M tri-sodium citrate, sitting drop, temperature 295K |