5YDC
Crystal structure of mercury soaked C-terminal domain of Rv1828 from Mycobacterium tuberculosis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM14 |
Synchrotron site | ESRF |
Beamline | BM14 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-09-24 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.0080 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 45.355, 31.511, 77.901 |
Unit cell angles | 90.00, 98.21, 90.00 |
Refinement procedure
Resolution | 44.890 - 1.910 |
R-factor | 0.208 |
Rwork | 0.206 |
R-free | 0.26000 |
Structure solution method | SAD |
RMSD bond length | 0.013 |
RMSD bond angle | 1.547 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.930 |
High resolution limit [Å] | 1.905 | 1.910 |
Rmerge | 0.100 | 1.280 |
Number of reflections | 16754 | |
<I/σ(I)> | 20 | 3.1 |
Completeness [%] | 97.3 | 95.4 |
Redundancy | 7.9 | 7.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | 2.2 M Ammonium sulfate, 0.1 M Bis-Tris (pH 6.5) |