2WGE
Crystal structure of KasA of Mycobacterium tuberculosis with bound TLM
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-1 |
Synchrotron site | ESRF |
Beamline | ID14-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC CCD |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 77.542, 77.542, 148.458 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 49.810 - 1.800 |
R-factor | 0.16902 |
Rwork | 0.167 |
R-free | 0.20129 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2wgd |
RMSD bond length | 0.013 |
RMSD bond angle | 1.421 |
Data reduction software | MOSFLM |
Data scaling software | SCALA ((CCP4)) |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.060 | 1.900 |
High resolution limit [Å] | 1.790 | 1.800 |
Rmerge | 0.060 | 0.320 |
Number of reflections | 48833 | |
<I/σ(I)> | 19.1 | 7.5 |
Completeness [%] | 99.0 | 93.2 |
Redundancy | 6.7 | 6.45 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 2-PROPANOL NACL HEPES PH 7.5 |