3BKU
Apo C-terminal Domain of NikR
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X12B |
Synchrotron site | NSLS |
Beamline | X12B |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-06-06 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.100 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 67.350, 59.660, 75.140 |
Unit cell angles | 90.00, 94.01, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.100 |
R-factor | 0.291 |
Rwork | 0.288 |
R-free | 0.33600 |
Starting model (for MR) | Ni-bound C-terminal domain of NikR (1Q5Y) |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | EPMR |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.180 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.080 | 0.459 |
Number of reflections | 17408 | |
<I/σ(I)> | 17.9 | 1.7 |
Completeness [%] | 99.5 | 96.7 |
Redundancy | 7.3 | 2.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | 0.2M Na Tartrate, 20% w/v PEG 3350, pH 8.0, vapor diffusion, hanging drop, temperature 298K |