6SYW
human Aldose Reductase in complex with SAR25
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-06-01 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9184 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 47.318, 66.856, 49.286 |
| Unit cell angles | 90.00, 91.99, 90.00 |
Refinement procedure
| Resolution | 39.660 - 0.930 |
| Rwork | 0.109 |
| R-free | 0.12290 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4prt |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.10.1-2155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.290 | 0.990 |
| High resolution limit [Å] | 0.930 | 0.930 |
| Number of reflections | 181142 | 19356 |
| <I/σ(I)> | 15.7 | 2.5 |
| Completeness [%] | 88.1 | 58.3 |
| Redundancy | 4.5 | 3.8 |
| CC(1/2) | 1.000 | 0.810 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5 | 291 | PEG 6000, DTT, diammonium hydrogen citrate, NADP+ |
