5JGW
Crystal structure of maize AKR4C13 in complex with NADP and acetate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-1 |
Synchrotron site | ESRF |
Beamline | ID14-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-08-06 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.9334 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 114.654, 115.467, 124.938 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 84.800 - 2.300 |
R-factor | 0.2138 |
Rwork | 0.212 |
R-free | 0.24520 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.014 |
RMSD bond angle | 1.490 |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 84.800 | 2.440 | |
High resolution limit [Å] | 2.300 | 6.800 | 2.300 |
Rmerge | 0.050 | 0.019 | 0.647 |
Number of reflections | 140645 | ||
<I/σ(I)> | 16.76 | 54.37 | 2.19 |
Completeness [%] | 99.1 | 93.3 | 98.2 |
Redundancy | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 291 | 0.1 M sodium acetate pH 4.5 and 25% m/v PEG3350 |