6R2F
Crystal structure of TEX12 F102A F109E V116A in an alternative conformation
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-01-25 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9786 |
Spacegroup name | I 21 21 21 |
Unit cell lengths | 59.860, 104.510, 127.510 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.410 - 2.290 |
R-factor | 0.239 |
Rwork | 0.238 |
R-free | 0.26210 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | Ab initio models |
RMSD bond length | 0.007 |
RMSD bond angle | 0.941 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((1.14_3260: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.410 | 2.370 |
High resolution limit [Å] | 2.290 | 2.290 |
Rmerge | 0.134 | 1.419 |
Rmeas | 0.144 | 1.525 |
Rpim | 0.053 | 0.552 |
Number of reflections | 18314 | 1770 |
<I/σ(I)> | 8.7 | 1.6 |
Completeness [%] | 99.6 | |
Redundancy | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.2 M lithum nitrate, 40 % MPD |