7CSH
AtPrR2 with NADP+ and (+)pinoresinol
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2016-03-12 |
| Detector | MAR555 FLAT PANEL |
| Wavelength(s) | 0.9798 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 78.001, 90.465, 117.562 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 39.001 - 1.591 |
| R-factor | 0.156809859231 |
| Rwork | 0.156 |
| R-free | 0.18348 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1qyd |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.161 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.10_2155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.001 | 1.650 |
| High resolution limit [Å] | 1.590 | 1.590 |
| Rmerge | 0.102 | 0.475 |
| Number of reflections | 55657 | 5475 |
| <I/σ(I)> | 20.7 | |
| Completeness [%] | 99.7 | |
| Redundancy | 12.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 277 | 2.1 M DL malic acid, pH 7.0 |
