5IE2
Crystal structure of a plant enzyme
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-11-01 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.00800 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 71.228, 117.042, 72.023 |
| Unit cell angles | 90.00, 93.58, 90.00 |
Refinement procedure
| Resolution | 28.687 - 1.850 |
| R-factor | 0.15 |
| Rwork | 0.149 |
| R-free | 0.18930 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.582 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.920 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Rmerge | 0.100 | 0.662 |
| Number of reflections | 100260 | |
| <I/σ(I)> | 18.8 | 3.4 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 7.3 | 7.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | EVAPORATION | 5.6 | 291 | 0.2M ammonium acetate, 0.1M sodium citrate tribasic (pH 5.6), 30% PEG 4000, 0.066mM tridecylmaltoside |
