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 |