1PC6
Structural Genomics, NinB
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2002-07-02 |
| Detector | SBC-2 |
| Wavelength(s) | 0.9795,0.9797,0.94656 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 76.776, 76.776, 107.390 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 36.200 * - 2.500* |
| R-factor | 0.234 |
| Rwork | 0.234 |
| R-free | 0.29400 |
| Structure solution method | MAD |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.200 |
| Data reduction software | d*TREK |
| Data scaling software | HKL-2000 |
| Phasing software | CNS |
| Refinement software | CNS (0.9) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.590 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.079 | 0.492 |
| Total number of observations | 100809 * | |
| Number of reflections | 12916 | |
| <I/σ(I)> | 29 | 2.24 |
| Completeness [%] | 99.0 | 98.4 |
| Redundancy | 7.8 | 6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion * | 8 * | 21 * | 1.4M Na(AC), Sodium cacodylate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | Tris-HCl | 20 (mM) | pH8.0 |
| 2 | 1 | drop | EDTA | 1 (mM) | |
| 3 | 1 | drop | dithiothreitol | 0.5 (mM) | |
| 4 | 1 | drop | 500 (mM) | ||
| 5 | 1 | drop | glycerol | 50 (%) | |
| 6 | 1 | drop | protein | 1.3 (mg/ml) | |
| 7 | 1 | reservoir | sodium acetate | 1.4 (M) | |
| 8 | 1 | reservoir | sodium cacodylate | 0.05 (M) | pH6.9 |
