4OGF
Crystal Structure of Human DJ-1 with glyoxylate as substrate analog
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-17A |
Synchrotron site | Photon Factory |
Beamline | BL-17A |
Detector technology | CCD |
Collection date | 2012-05-29 |
Detector | ADSC QUANTUM 315r |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 74.692, 74.692, 74.937 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 50.000 - 1.600 |
Rwork | 0.212 |
R-free | 0.23470 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1pdv |
RMSD bond length | 0.005 |
RMSD bond angle | 1.281 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Refinement software | CNS |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.660 |
High resolution limit [Å] | 1.600 | 3.450 | 1.600 |
Rmerge | 0.047 | 0.028 | 0.392 |
Number of reflections | 32086 | ||
<I/σ(I)> | 13.1 | ||
Completeness [%] | 99.1 | 99.4 | 97.4 |
Redundancy | 7.4 | 10 | 4.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 0.1 M HEPES, 1.4 M sodium citrate, pH 7.5, VAPOR DIFFUSION, HANGING DROP |