1YNQ
aldo-keto reductase AKR11C1 from Bacillus halodurans (holo form)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-06-01 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.97934 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 75.122, 87.543, 105.434 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 67.420 - 1.300 |
| R-factor | 0.15339 |
| Rwork | 0.152 |
| R-free | 0.18534 |
| Structure solution method | isomorphous |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.715 |
| Data scaling software | XDS |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 38.710 | 1.400 |
| High resolution limit [Å] | 1.300 | 1.300 |
| Rmerge | 0.085 | 0.506 |
| Number of reflections | 169631 | |
| <I/σ(I)> | 9.38 | 3.5 |
| Completeness [%] | 99.4 | 99 |
| Redundancy | 5.4 | 4.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 293 | (NH4)2SO4, Li2SO4, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
