1Y1P
X-ray structure of aldehyde reductase with NADPH
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-6A |
Synchrotron site | Photon Factory |
Beamline | BL-6A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-10-21 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 55.000, 83.391, 148.324 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 74.160 - 1.600 |
R-factor | 0.217 |
Rwork | 0.217 |
R-free | 0.23900 |
Structure solution method | SAD |
RMSD bond length | 0.005 |
RMSD bond angle | 1.200 |
Data reduction software | HKL-2000 |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | SOLVE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 74.160 | 1.700 |
High resolution limit [Å] | 1.600 | 1.600 |
Number of reflections | 84533 | |
Completeness [%] | 93.1 | 99.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 293 | 32% (w/v) polyethylene glycol 2000 MME, 100mM ammonium sulfate and 200mM sodium acetate, pH 5.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 293 | 32% (w/v) polyethylene glycol 2000 MME, 100mM ammonium sulfate and 200mM sodium acetate, pH 5.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |