7LHR
Crystal structure of adenosine-5'-phosphosulfate reductase from Mycobacterium tuberculosis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-11-30 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.9792 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 77.414, 77.414, 204.352 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.250 - 3.110 |
R-factor | 0.2095 |
Rwork | 0.207 |
R-free | 0.24920 |
Structure solution method | SAD |
RMSD bond length | 0.003 |
RMSD bond angle | 0.606 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.150 |
High resolution limit [Å] | 3.100 | 3.100 |
Number of reflections | 11937 | 568 |
<I/σ(I)> | 32.4 | |
Completeness [%] | 100.0 | |
Redundancy | 23.3 | |
CC(1/2) | 0.616 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293 | 0.1 M MES, 10-12% (w/v) PEG 20000 |