4DDW
Thermotoga maritima reverse gyrase, c-centered orthorhombic form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2011-11-28 |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 174.325, 175.646, 104.135 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.749 - 3.900 |
R-factor | 0.2129 |
Rwork | 0.209 |
R-free | 0.28880 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4ddt |
RMSD bond length | 0.005 |
RMSD bond angle | 0.600 |
Data reduction software | XDS ((VERSION December 6) |
Data scaling software | SADABS |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: dev_881)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.980 | 4.000 |
High resolution limit [Å] | 3.900 | 3.900 |
Rmerge | 0.162 | 0.827 |
Number of reflections | 14481 | |
<I/σ(I)> | 7.7 | 1.23 |
Completeness [%] | 96.9 | 94 |
Redundancy | 5.45 | 5.54 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 295 | 0.2M Mg(OAc)2, 20% PEG3350, 0.15M sodium citrate, VAPOR DIFFUSION, SITTING DROP, temperature 295K |