2XTA
Crystal structure of the SucA domain of Mycobacterium smegmatis alpha- ketoglutarate decarboxylase in complex with acetyl-CoA (triclinic form)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-11-21 |
Detector | MARMOSAIC 225 mm CCD |
Spacegroup name | P 1 |
Unit cell lengths | 80.550, 83.580, 160.070 |
Unit cell angles | 99.59, 98.94, 100.68 |
Refinement procedure
Resolution | 78.110 - 2.200 |
R-factor | 0.1892 |
Rwork | 0.188 |
R-free | 0.21360 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2XT9 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.020 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | BUSTER (2.9.3) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 78.100 | 2.310 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.070 | 0.400 |
Number of reflections | 187791 | |
<I/σ(I)> | 8.7 | 2.2 |
Completeness [%] | 92.6 | 88.5 |
Redundancy | 2 | 2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.6 | 54% MPD, 25 MM SODIUM ACETATE, pH 7.6 |