5WHM
Crystal Structure of IclR Family Transcriptional Regulator from Brucella abortus
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-02-27 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97927 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 74.152, 112.462, 83.649 |
Unit cell angles | 90.00, 115.86, 90.00 |
Refinement procedure
Resolution | 33.556 - 1.950 |
R-factor | 0.1789 |
Rwork | 0.177 |
R-free | 0.21230 |
Structure solution method | SAD |
RMSD bond length | 0.010 |
RMSD bond angle | 1.042 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | HKL-3000 |
Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.980 |
High resolution limit [Å] | 1.950 | 1.950 |
Rpim | 0.055 | 0.517 |
Number of reflections | 89094 | 4102 |
<I/σ(I)> | 18.9 | 1.53 |
Completeness [%] | 99.4 | 93.1 |
Redundancy | 4.1 | 2.8 |
CC(1/2) | 0.534 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 289 | 0.2 M calcium acetate, 0.1 M HEPES:NaOH, pH 7.5, 10% w/v PEG8000 |