3D6Z
Crystal structure of R275E mutant of BMRR bound to DNA and rhodamine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.1 |
Synchrotron site | ALS |
Beamline | 8.2.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-07-25 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.9789 |
Spacegroup name | P 43 2 2 |
Unit cell lengths | 106.500, 106.500, 146.140 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 52.400 - 2.600 |
R-factor | 0.226 |
Rwork | 0.226 |
R-free | 0.26300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1r8e |
RMSD bond length | 0.007 |
RMSD bond angle | 1.400 |
Data reduction software | MOSFLM |
Data scaling software | SCALEPACK |
Phasing software | EPMR |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 52.400 | 2.740 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.054 | 0.511 |
Number of reflections | 26429 | |
<I/σ(I)> | 18.2 | 3.7 |
Completeness [%] | 99.7 | 99.6 |
Redundancy | 3.5 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | SODIUM MALONATE, JEFFAMINE-M600, pH 7.00, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
Crystallization Reagents
ID | crystal ID | solution ID | reagent name | concentration | details |
1 | 1 | 1 | SODIUM MALONATE | ||
2 | 1 | 2 | SODIUM MALONATE | ||
3 | 1 | 1 | JEFFAMINE-M600 | ||
4 | 1 | 2 | JEFFAMINE-M600 |