1N2F
CRYSTAL STRUCTURE OF P. AERUGINOSA OHR
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X9A |
| Synchrotron site | NSLS |
| Beamline | X9A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2002-02-26 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.979,0.979,0.961 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 39.911, 77.510, 43.079 |
| Unit cell angles | 90.00, 116.28, 90.00 |
Refinement procedure
| Resolution | 8.000 * - 2.000* |
| R-factor | 0.22 |
| Rwork | 0.220 |
| R-free | 0.25000 * |
| Structure solution method | MAD |
| RMSD bond length | 0.005 * |
| RMSD bond angle | 1.310 * |
| Data reduction software | DENZO |
| Phasing software | CNS |
| Refinement software | CNS (1.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 * | 2.090 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.053 * | |
| Number of reflections | 29936 | |
| Completeness [%] | 97.9 * | 96.5 |
| Redundancy | 2.1 * |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 * | 293 | pH 7, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 20 (mg/ml) | |
| 2 | 1 | drop | Tris | 5 (mM) | pH8.0 |
| 3 | 1 | drop | dithiothreitol | 5 (mM) | |
| 4 | 1 | reservoir | sodium acetate | 0.2 (M) | |
| 5 | 1 | reservoir | PEG5000 MME | 30 (%) | |
| 6 | 1 | reservoir | Tris | 0.1 (M) | pH8.0 |
