6O6O
Structure of the regulator FasR from Mycobacterium tuberculosis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2016-04-26 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.54179 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 86.130, 100.180, 38.520 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.780 - 1.630 |
R-factor | 0.219 |
Rwork | 0.219 |
R-free | 0.23700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6o6n |
RMSD bond length | 0.010 |
RMSD bond angle | 0.900 |
Data reduction software | TRUNCATE |
Data scaling software | Aimless (0.5.25) |
Phasing software | PHASER |
Refinement software | BUSTER (2.10.3) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 28.780 | 28.780 | 1.660 |
High resolution limit [Å] | 1.630 | 8.930 | 1.630 |
Rmerge | 0.039 | 0.026 | 0.467 |
Rmeas | 0.046 | 0.032 | 0.549 |
Rpim | 0.024 | 0.018 | 0.284 |
Total number of observations | 147330 | 927 | 7005 |
Number of reflections | 41807 | 313 | 1999 |
<I/σ(I)> | 11.3 | 24.7 | 1.8 |
Completeness [%] | 98.6 | 97.4 | 96.4 |
Redundancy | 3.5 | 3 | 3.5 |
CC(1/2) | 0.999 | 0.997 | 0.798 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | 22% v/v PEG400 |