4IHU
Reduced form of disulfide bond oxdioreductase (DsbG) from Mycobacterium tuberculosis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.2 |
Synchrotron site | ALS |
Beamline | 5.0.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-05-18 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97602 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 71.030, 76.710, 86.960 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 44.700 - 1.896 |
R-factor | 0.2024 |
Rwork | 0.201 |
R-free | 0.23130 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3eu3 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.109 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | SHELXS |
Refinement software | PHENIX ((phenix.refine: 1.8_1069)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.700 | 1.943 |
High resolution limit [Å] | 1.890 | 1.896 |
Rmerge | 0.074 | 0.393 |
Number of reflections | 38375 | |
Completeness [%] | 100.0 | 100 |
Redundancy | 10.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 298 | 1.9 M ammonium sulfate, 9% isopropanol, pH 7.4, VAPOR DIFFUSION, HANGING DROP, temperature 298K |