8QKF
SmtB protein of Mycobacterium smegmatis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-11-23 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.0332 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 42.292, 72.479, 82.226 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 41.110 - 1.880 |
R-factor | 0.19642 |
Rwork | 0.194 |
R-free | 0.24351 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.016 |
RMSD bond angle | 1.897 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHENIX |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 41.110 | 1.990 |
High resolution limit [Å] | 1.880 | 1.880 |
Rmerge | 0.066 | |
Rmeas | 0.073 | |
Number of reflections | 21130 | 3401 |
<I/σ(I)> | 13.25 | |
Completeness [%] | 99.3 | |
Redundancy | 7.3 | |
CC(1/2) | 0.248 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 295 | L-Proline, PEG 3350, HEPES |