2VEF
Dihydropteroate synthase from Streptococcus pneumoniae
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX14.1 |
Synchrotron site | SRS |
Beamline | PX14.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 45.613, 90.382, 138.656 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.180 - 1.800 |
R-factor | 0.197 |
Rwork | 0.194 |
R-free | 0.24000 |
Structure solution method | SAD |
Starting model (for MR) | NONE |
RMSD bond length | 0.021 |
RMSD bond angle | 1.622 |
Data reduction software | CrystalClear |
Data scaling software | CrystalClear |
Phasing software | SOLVE |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 55.000 | 1.900 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.050 | 0.210 |
Number of reflections | 65291 | |
<I/σ(I)> | 12.7 | 4.5 |
Completeness [%] | 99.0 | 93.9 |
Redundancy | 3.43 | 2.89 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 0.2 M AMMONIUM IODIDE, 20% (W/V) POLYETHYLENE GLYCOL 3,350 |