1U8R
Crystal Structure of an IdeR-DNA Complex Reveals a Conformational Change in Activated IdeR for Base-specific Interactions
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.2 |
Synchrotron site | ALS |
Beamline | 8.2.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-05-18 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.0722 |
Spacegroup name | P 31 |
Unit cell lengths | 107.959, 107.959, 215.124 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.750 - 2.750 |
R-factor | 0.232 |
Rwork | 0.230 |
R-free | 0.26500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1FX7 and 1DDN |
RMSD bond length | 0.007 |
RMSD bond angle | 1.300 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.850 |
High resolution limit [Å] | 2.750 | 2.750 |
Number of reflections | 63753 | |
<I/σ(I)> | 10.87 | 2.09 |
Completeness [%] | 86.5 | 65.5 |
Redundancy | 3.04 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 7% w/v PEG 8000, 0.2 M calcium acetate, 0.1 M imidazole, 0.01 M cobalt chloride, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
Crystallization Reagents
ID | crystal ID | solution ID | reagent name | concentration | details |
1 | 1 | 1 | PEG 8000 | ||
2 | 1 | 1 | calcium acetate | ||
3 | 1 | 1 | imidazol | ||
4 | 1 | 1 | cobalt chloride | ||
5 | 1 | 1 | H2O | ||
6 | 1 | 2 | PEG 8000 | ||
7 | 1 | 2 | calcium acetate | ||
8 | 1 | 2 | cobalt chloride | ||
9 | 1 | 2 | H2O |