5CCT
Staphylococcus bacteriophage 80alpha dUTPase G164S mutant with dUpNHpp.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALBA BEAMLINE XALOC |
Synchrotron site | ALBA |
Beamline | XALOC |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-02-21 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.98 |
Spacegroup name | P 21 3 |
Unit cell lengths | 87.464, 87.464, 87.464 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.730 - 2.400 |
R-factor | 0.2172 |
Rwork | 0.216 |
R-free | 0.24930 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3zez |
RMSD bond length | 0.002 |
RMSD bond angle | 0.609 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.730 | 2.530 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.338 | |
Number of reflections | 8960 | |
<I/σ(I)> | 13.4 | 4.9 |
Completeness [%] | 99.6 | 98.4 |
Redundancy | 5.2 | 4.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 294 | 18% ethanol, 0.1M Tris-HCl pH 8.5 |