7A7T
rsGreenF partially in the green-off state
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 2 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-06-28 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 0.9801 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 37.617, 62.263, 48.460 |
Unit cell angles | 90.00, 90.36, 90.00 |
Refinement procedure
Resolution | 48.459 - 1.580 |
R-factor | 0.1638 |
Rwork | 0.162 |
R-free | 0.19670 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 0.904 |
Data reduction software | XDS |
Data scaling software | Aimless (0.5.32) |
Phasing software | PHENIX (1.11) |
Refinement software | PHENIX (1.11) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 48.460 | 48.460 | 1.610 |
High resolution limit [Å] | 1.580 | 8.650 | 1.580 |
Rmerge | 0.054 | 0.035 | 0.667 |
Rmeas | 0.058 | 0.039 | 0.737 |
Rpim | 0.022 | 0.016 | 0.305 |
Total number of observations | 203376 | ||
Number of reflections | 30705 | 205 | 1492 |
<I/σ(I)> | 17.2 | ||
Completeness [%] | 100.0 | 99.2 | 99.9 |
Redundancy | 6.6 | 5.4 | 5.9 |
CC(1/2) | 0.999 | 0.998 | 0.840 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 100 mM MIB pH 4.0 25 % PEG 1500 |