3VP5
X-ray Crystal Structure of Wild Type HrtR in the Holo Form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL26B2 |
Synchrotron site | SPring-8 |
Beamline | BL26B2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-12-15 |
Detector | MarMosaic225 Rayonix |
Wavelength(s) | 1.000 |
Spacegroup name | P 2 2 21 |
Unit cell lengths | 48.140, 51.998, 87.477 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 17.663 - 1.900 |
R-factor | 0.2134 |
Rwork | 0.211 |
R-free | 0.26490 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.013 |
RMSD bond angle | 1.297 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | PHENIX (1.7.3_928) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 1.970 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.040 | 0.241 |
Number of reflections | 17259 | |
<I/σ(I)> | 32.961 | 5.691 |
Completeness [%] | 96.1 | 82.1 |
Redundancy | 7 | 6.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | 19 % (w/v) polyethylene glycol 4000, 0.1M sodium cacodylate, 0.2M magnesium chloride, pH 6.0, vapor diffusion, hanging drop, temperature 293K |