5M2F
Crystal structure of human AKR1B10 complexed with NADP+ and the synthetic retinoid UVI2008
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-05-16 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.729 |
| Spacegroup name | P 31 |
| Unit cell lengths | 79.475, 79.475, 49.823 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 40.359 - 1.503 |
| R-factor | 0.212 |
| Rwork | 0.210 |
| R-free | 0.24070 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1zua |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.175 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.8_1069) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.550 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Number of reflections | 55875 | |
| <I/σ(I)> | 16.9 | 2.3 |
| Completeness [%] | 99.7 | 98.22 |
| Redundancy | 2.6 | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 9 | 293 | 30% PEG 6000, 100 mM sodium cacodylate |
