8Q2A
TtX122B - A domain of unknown function from the Teredinibacter turnerae protein TERTU_2913
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 | 2018-09-15 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.96863 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 69.141, 75.324, 116.863 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.690 - 2.200 |
Rwork | 0.208 |
R-free | 0.25900 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.016 |
RMSD bond angle | 2.031 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0419) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 46.690 | 46.690 | 2.270 |
High resolution limit [Å] | 2.200 | 9.070 | 2.200 |
Rmerge | 0.365 | 0.133 | 2.304 |
Rmeas | 0.432 | 0.156 | 2.805 |
Rpim | 0.228 | 0.080 | 1.568 |
Number of reflections | 31699 | 531 | 15164 |
<I/σ(I)> | 6.2 | ||
Completeness [%] | 99.8 | ||
Redundancy | 6.8 | 5.8 | 5.6 |
CC(1/2) | 0.601 | 0.964 | 0.726 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 292 | 0.2 M NaCl, 25% PEG3350 and 0.1 M Bis-Tris pH 6.5 |