6QVF
TT_C0855 competence pilin from Thermus thermophilus HB27
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-01-26 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.97624 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 50.588, 137.815, 59.739 |
Unit cell angles | 90.00, 98.18, 90.00 |
Refinement procedure
Resolution | 68.910 - 1.440 |
R-factor | 0.1518 |
Rwork | 0.151 |
R-free | 0.18930 |
Structure solution method | SIRAS |
RMSD bond length | 0.011 |
RMSD bond angle | 1.435 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | PHENIX |
Refinement software | REFMAC (5.8.0230) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 69.000 | 1.440 |
High resolution limit [Å] | 1.390 | 1.390 |
Rmerge | 0.059 | |
Rmeas | 0.070 | |
Rpim | 0.038 | |
Number of reflections | 154421 | |
<I/σ(I)> | 8.6 | |
Completeness [%] | 86.5 | 59.3 |
Redundancy | 3.4 | 2.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 0.2 M ammonium nitrate, 0.1 M Bis-Tris propane pH 8.5, and 18% v/v PEG Smear High |