4NB5
Crystal Structure of a transcriptional regulator
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-E |
| Synchrotron site | APS |
| Beamline | 24-ID-E |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-06-26 |
| Detector | ACSD |
| Wavelength(s) | 0.98 |
| Spacegroup name | P 1 |
| Unit cell lengths | 54.539, 57.245, 61.441 |
| Unit cell angles | 82.24, 68.40, 72.20 |
Refinement procedure
| Resolution | 41.165 - 1.641 |
| R-factor | 0.1674 |
| Rwork | 0.166 |
| R-free | 0.19050 |
| Structure solution method | SAD |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.902 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | MLPHARE |
| Refinement software | PHENIX (1.8.1_1168) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.700 |
| High resolution limit [Å] | 1.640 | 3.530 | 1.640 |
| Rmerge | 0.044 | 0.021 | 0.395 |
| Number of reflections | 78058 | ||
| <I/σ(I)> | 10.7 | ||
| Completeness [%] | 97.0 | 98.2 | 95.6 |
| Redundancy | 2 | 2 | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 4 | 298 | 25% PEG1000, 0.05M NaCl, 0.1M NaAc(4.0), and 4% glycerol, vapor diffusion, temperature 298K |
