3WGH
Crystal structure of RSP in complex with beta-NADH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSRRC BEAMLINE BL13B1 |
| Synchrotron site | NSRRC |
| Beamline | BL13B1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-10-16 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 56.793, 75.123, 59.208 |
| Unit cell angles | 90.00, 94.37, 90.00 |
Refinement procedure
| Resolution | 22.610 - 2.050 |
| R-factor | 0.1801 |
| Rwork | 0.177 |
| R-free | 0.23676 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | PDB 3WG9 |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.714 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.000 | 2.120 |
| High resolution limit [Å] | 2.050 | 2.050 |
| Rmerge | 0.053 | 0.434 |
| Number of reflections | 30614 | |
| <I/σ(I)> | 26.7 | 2.2 |
| Completeness [%] | 98.1 | 88.5 |
| Redundancy | 4 | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 298 | 0.16M zinc acetate, 0.08M sodium cacodylate, 14.4% PEG 8000, 20% glycerol, 5mM alpha-NADH, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K |
