1OXW
The Crystal Structure of SeMet Patatin
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 113 |
| Detector technology | CCD |
| Collection date | 1999-08-25 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.9791, 0.9792, 1.019, 0.9419 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 97.180, 171.420, 129.880 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.200 |
| Rwork | 0.220 |
| R-free | 0.27200 |
| Structure solution method | MAD |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.272 |
| Data scaling software | SCALEPACK |
| Phasing software | SOLVE (& AMoRE) |
| Refinement software | X-PLOR (98.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.280 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.077 * | |
| Total number of observations | 762165 * | |
| Number of reflections | 55261 * | |
| <I/σ(I)> | 36.2 | 7 |
| Completeness [%] | 100.0 * | 80.4 |
| Redundancy | 13.8 * | 2.95 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 298 | PEG 3350, AMMONIUM ACETATE, TRIS BUFFER, pH 7.4, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 10 (mg/ml) | |
| 2 | 1 | drop | Tris | 10 (mM) | pH7.4 |
| 3 | 1 | reservoir | PEG3350 | 16 (%) | |
| 4 | 1 | reservoir | ammonium acetate | 0.24 (M) |
