7CSB
AtPrR1 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 | P 1 21 1 |
| Unit cell lengths | 74.156, 144.716, 77.021 |
| Unit cell angles | 90.00, 116.29, 90.00 |
Refinement procedure
| Resolution | 33.900 - 2.002 |
| R-factor | 0.20112262014 |
| Rwork | 0.200 |
| R-free | 0.23908 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1qyd |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.883 |
| 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] | 33.900 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.092 | 0.719 |
| Number of reflections | 86455 | 9547 |
| <I/σ(I)> | 24.2 | |
| Completeness [%] | 89.2 | |
| Redundancy | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 277 | 0.2 M sodium fluoride, 20% w/v PEG 3350 |
