4UUB
Crystal structure of zebrafish Sirtuin 5 in complex with 2R-butyl- succinylated CPS1-peptide
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 | 2013-07-05 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 65 2 2 |
| Unit cell lengths | 87.440, 87.440, 315.060 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 48.440 - 2.900 |
| R-factor | 0.20549 |
| Rwork | 0.203 |
| R-free | 0.25387 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2nyr |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.558 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 3.000 |
| High resolution limit [Å] | 2.900 | 2.900 |
| Rmerge | 0.170 | 1.010 |
| Number of reflections | 16737 | |
| <I/σ(I)> | 13.3 | 1.9 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 8.1 | 6.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.2 | 20% PEG3350, 0.1 M HEPES PH 7.2 |
