6BWG
Crystal structure of native Rv2983 from Mycobacterium tuberculosis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-12-12 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.95370 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 66.546, 109.058, 166.498 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.900 - 1.990 |
R-factor | 0.19408 |
Rwork | 0.192 |
R-free | 0.23448 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.016 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | Auto-Rickshaw |
Refinement software | REFMAC (5.8.0230) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.920 | 2.040 |
High resolution limit [Å] | 1.990 | 1.990 |
Number of reflections | 41955 | |
<I/σ(I)> | 8.8 | |
Completeness [%] | 99.8 | |
Redundancy | 14.8 | |
CC(1/2) | 0.994 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291.15 | 30% PEG 1500, 3% MPD, 0.2 M MgSO4, 0.1 M sodium acetate pH 5.0 |