5SY9
Atomic resolution structure of E15Q mutant human DJ-1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL9-2 |
| Synchrotron site | SSRL |
| Beamline | BL9-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-02-24 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.88 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 86.276, 121.963, 43.512 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 37.000 - 1.100 |
| R-factor | 0.11837 |
| Rwork | 0.118 |
| R-free | 0.13735 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1p5f |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.821 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0151) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.000 | 1.120 |
| High resolution limit [Å] | 1.100 | 1.100 |
| Rmerge | 0.070 | 1.066 |
| Number of reflections | 91327 | |
| <I/σ(I)> | 14.9 | 1.4 |
| Completeness [%] | 98.1 | 85.4 |
| Redundancy | 5.1 | 3.8 |
| CC(1/2) | 0.999 | 0.569 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 298 | 25-28% PEG 4000, 0.1 M Tris HCl, 0.1 M sodium citrate |
