6WLP
Crystal Structure of the ZTL light-state mimic G46S
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CHESS BEAMLINE F1 |
Synchrotron site | CHESS |
Beamline | F1 |
Temperature [K] | 80 |
Detector technology | PIXEL |
Collection date | 2016-11-17 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9773 |
Spacegroup name | I 21 3 |
Unit cell lengths | 265.069, 265.069, 265.069 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.860 - 3.000 |
R-factor | 0.1942 |
Rwork | 0.193 |
R-free | 0.22240 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5svu |
RMSD bond length | 0.016 |
RMSD bond angle | 1.601 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.860 | 3.050 |
High resolution limit [Å] | 3.000 | 3.000 |
Rmerge | 0.130 | |
Number of reflections | 61739 | 3080 |
<I/σ(I)> | 2.95 | |
Completeness [%] | 99.9 | |
Redundancy | 5.4 | |
CC(1/2) | 0.699 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 0.05 M TRIS pH 8.5, 2.0 M Ammonium sulfate |