3NX4
Crystal structure of the yhdH oxidoreductase from Salmonella enterica in complex with NADP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Temperature [K] | 110 |
| Detector technology | CCD |
| Collection date | 2010-04-25 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.97857 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 103.218, 122.364, 64.912 |
| Unit cell angles | 90.00, 121.10, 90.00 |
Refinement procedure
| Resolution | 37.042 - 1.900 |
| R-factor | 0.1561 |
| Rwork | 0.155 |
| R-free | 0.19080 |
| Structure solution method | SAD |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.120 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SHELXS |
| Refinement software | PHENIX (1.6.2_432) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.970 |
| High resolution limit [Å] | 1.900 | 4.090 | 1.900 |
| Rmerge | 0.101 | 0.071 | 0.546 |
| Number of reflections | 51747 | ||
| <I/σ(I)> | 11.5 | 23.11 | 2.56 |
| Completeness [%] | 95.2 | 99.5 | 83.8 |
| Redundancy | 9.4 | 10.5 | 6.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | 20% PEG3350, 200mM Ammonium Citrate, 10mM NADP, pH 7, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
