4TKL
Crystal structure of NADH-dependent reductase A1-R' responsible for alginate metabolism
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL38B1 |
| Synchrotron site | SPring-8 |
| Beamline | BL38B1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-10-25 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 87.717, 87.717, 139.598 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 33.390 - 1.800 |
| R-factor | 0.18216 |
| Rwork | 0.181 |
| R-free | 0.19944 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3afm |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.157 |
| Data scaling software | HKL-2000 |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.860 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.060 | 0.384 |
| Number of reflections | 58400 | |
| <I/σ(I)> | 47.3 | 5.8 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 11.7 | 11.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.2 | 293 | PEG 400, sodium/potassium phosphate, sodium chloride |
