4UUA
Crystal structure of zebrafish Sirtuin 5 in complex with 3S-Z-amino- 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 | 2013-04-17 |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 87.190, 87.190, 313.870 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 19.870 - 2.800 |
R-factor | 0.21071 |
Rwork | 0.208 |
R-free | 0.26138 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2nyr |
RMSD bond length | 0.012 |
RMSD bond angle | 1.690 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.900 |
High resolution limit [Å] | 2.800 | 2.800 |
Rmerge | 0.250 | |
Number of reflections | 18292 | |
<I/σ(I)> | 10.6 | 1.3 |
Completeness [%] | 99.6 | 100 |
Redundancy | 10.5 | 11.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.6 | 20% PEG3350, 0.1 M HEPES PH 7.6 |