6ARB
CRYSTAL STRUCTURE OF PROTEIN CitE FROM MYCOBACTERIUM TUBERCULOSIS IN COMPLEX WITH MAGNESIUM, PYRUVATE AND COENZYME A
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 31-ID |
Synchrotron site | APS |
Beamline | 31-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-06-15 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97931 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 127.533, 73.491, 86.459 |
Unit cell angles | 90.00, 99.14, 90.00 |
Refinement procedure
Resolution | 28.454 - 1.717 |
R-factor | 0.2207 |
Rwork | 0.219 |
R-free | 0.26160 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1u5h |
RMSD bond length | 0.007 |
RMSD bond angle | 1.056 |
Data reduction software | MOSFLM |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.7.1_743) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 28.454 |
High resolution limit [Å] | 1.717 |
Rmerge | 0.109 |
Number of reflections | 163623 |
<I/σ(I)> | 15.6 |
Completeness [%] | 98.9 |
Redundancy | 4.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | 0.4 M Ammonium phosphate, no buffer |