4HBK
Structure of the Aldose Reductase from Schistosoma japonicum
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-05-03 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97906 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 67.486, 90.990, 54.667 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.714 - 2.200 |
R-factor | 0.1786 |
Rwork | 0.177 |
R-free | 0.21730 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2alr |
RMSD bond length | 0.007 |
RMSD bond angle | 1.023 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.6.1_353)) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 30.000 |
High resolution limit [Å] | 2.200 |
Number of reflections | 16851 |
Completeness [%] | 95.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.1 | 291 | 0.2 M Sodium fluoride, 30% w/v Polyethylene glycol 3,350, pH 7.1, VAPOR DIFFUSION, HANGING DROP, temperature 291K |