4Q0G
Crystal structure of beta subunit of acyl-CoA carboxylase AccD1 from Mycobacterium tuberculosis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2011-06-05 |
Detector | RAYONIX MX300HE |
Wavelength(s) | 0.97949 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 142.571, 221.253, 167.835 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.810 - 2.310 |
R-factor | 0.19044 |
Rwork | 0.189 |
R-free | 0.21325 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3u9r |
RMSD bond length | 0.005 |
RMSD bond angle | 1.015 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.810 | 2.380 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.157 | 0.817 |
Number of reflections | 115910 | |
<I/σ(I)> | 12.93 | 2.66 |
Completeness [%] | 99.7 | 100 |
Redundancy | 5.8 | 5.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 0.1 M sodium HEPES pH 7.5 and 30% PEG300, VAPOR DIFFUSION, HANGING DROP, temperature 298K |