5OJN
Sirtuin 4 from Xenopus tropicalis in complex with thioacetyl-ADP-ribose
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-09-08 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.976250 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 68.970, 74.880, 109.550 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.740 - 1.800 |
| R-factor | 0.15787 |
| Rwork | 0.155 |
| R-free | 0.20883 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5oj7 |
| RMSD bond length | 0.029 |
| RMSD bond angle | 2.438 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.850 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.055 | 1.040 |
| Number of reflections | 26585 | 1932 |
| <I/σ(I)> | 18.3 | 2.1 |
| Completeness [%] | 99.7 | 99.9 |
| Redundancy | 6.8 | 7.1 |
| CC(1/2) | 0.999 | 0.704 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 277 | 0.5 M Na/K-tartrate 0.5% PEG5000MME 0.1 M Tris |
