1INN
CRYSTAL STRUCTURE OF D. RADIODURANS LUXS, P21
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 32-ID |
| Synchrotron site | APS |
| Beamline | 32-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2000-09-05 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.9795, 0.9641 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 43.780, 82.260, 49.520 |
| Unit cell angles | 90.00, 102.79, 90.00 |
Refinement procedure
| Resolution | 20.000 - 1.800 |
| R-factor | 0.206 * |
| Rwork | 0.206 |
| R-free | 0.24000 |
| Structure solution method | MAD |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.500 |
| Data scaling software | SCALEPACK |
| Phasing software | SHARP |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 23.000 | 1.860 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.070 | 0.153 |
| Number of reflections | 53550 | |
| <I/σ(I)> | 16.4 | |
| Completeness [%] | 86.0 | 100 |
| Redundancy | 3.3 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 4 * | PEG MME 5000, MES, BME, NaCl, pH 6.5, VAPOR DIFFUSION, HANGING DROP at 277K, temperature 277.0K |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | reservoir | PEG5000 MME | 26 (%) | |
| 2 | 1 | reservoir | MES | 100 (mM) | |
| 3 | 1 | reservoir | beta-mercaptoethanol | 30 (mM) | |
| 4 | 1 | drop | protein | 19 (mg/ml) |
