3D3O
Crystal structure of the effector domain of the putative transcriptional regulator IclR from Acinetobacter sp. ADP1
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 | 2008-02-27 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97931 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 60.382, 71.681, 96.222 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.840 - 2.460 |
R-factor | 0.198 |
Rwork | 0.195 |
R-free | 0.26900 |
Structure solution method | SAD |
RMSD bond length | 0.017 |
RMSD bond angle | 1.656 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | HKL-3000 |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.840 | 2.500 |
High resolution limit [Å] | 2.460 | 2.460 |
Rmerge | 0.102 | 0.850 |
Number of reflections | 15652 | |
<I/σ(I)> | 10 | 2.3 |
Completeness [%] | 99.0 | 98.9 |
Redundancy | 9.2 | 9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.3 | 289 | 1.26M Ammonium sulfate, 0.1M CHES pH 9.5, 0.2M NaCl, pH 8.3, VAPOR DIFFUSION, SITTING DROP, temperature 289K |