3Q1M
Crystal Structure of BmrR Dimer bound to DNA and the ligand 4-amino-quinaldine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-06-24 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.97946 |
Spacegroup name | P 43 2 2 |
Unit cell lengths | 106.525, 106.525, 146.469 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.080 - 3.200 |
R-factor | 0.23096 |
Rwork | 0.229 |
R-free | 0.27244 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.399 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Refinement software | CNS |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 3.210 |
High resolution limit [Å] | 3.200 | 6.670 | 3.100 |
Number of reflections | 12613 | ||
Completeness [%] | 86.9 | 100 | 52 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 291 | 1.0 M Sodium Malonate, 0.05% Jeffamine-M600, pH 7, VAPOR DIFFUSION, HANGING DROP, temperature 291K |