5IE3
Crystal structure of a plant enzyme
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-03-20 |
| Detector | RIGAKU SATURN 944 |
| Wavelength(s) | 1.84178 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 71.193, 117.043, 72.062 |
| Unit cell angles | 90.00, 93.59, 90.00 |
Refinement procedure
| Resolution | 27.455 - 1.900 |
| R-factor | 0.1611 |
| Rwork | 0.160 |
| R-free | 0.20600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.332 |
| 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 | 27.450 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.102 | 0.643 |
| Number of reflections | 89721 | |
| <I/σ(I)> | 15.6 | 2.2 |
| Completeness [%] | 96.6 | |
| Redundancy | 6 | 4.4 |
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 |
