2O12
Mycobacterium tuberculosis Chorismate synthase in complex with FMN
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MPG/DESY, HAMBURG BEAMLINE BW6 |
Synchrotron site | MPG/DESY, HAMBURG |
Beamline | BW6 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-11-03 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1.05 |
Spacegroup name | P 64 2 2 |
Unit cell lengths | 133.445, 133.445, 158.619 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 19.740 - 1.720 |
R-factor | 0.1657 |
Rwork | 0.165 |
R-free | 0.18783 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.011 |
RMSD bond angle | 1.317 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 1.740 |
High resolution limit [Å] | 1.720 | 1.720 |
Rmerge | 0.086 | 0.932 |
Number of reflections | 88273 | |
<I/σ(I)> | 20.6 | 2.4 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 7 | 7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.5 | 291 | 4.8 M NH4-Acetate, 0.1 M Na-Acetate, pH 4.5, VAPOR DIFFUSION, SITTING DROP, temperature 291K |