2GK4
The Crystal Structure of the DNA/Pantothenate Metabolism Flavoprotein from Streptococcus pneumoniae
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-03-20 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97912 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 39.118, 64.594, 92.839 |
Unit cell angles | 90.00, 93.14, 90.00 |
Refinement procedure
Resolution | 37.660 - 1.830 |
R-factor | 0.18334 |
Rwork | 0.178 |
R-free | 0.22945 |
Structure solution method | SAD |
RMSD bond length | 0.014 |
RMSD bond angle | 1.371 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | HKL-3000 |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 37.660 | 1.860 |
High resolution limit [Å] | 1.830 | 1.830 |
Rmerge | 0.109 | 0.427 |
Number of reflections | 40925 | |
<I/σ(I)> | 9.3 | 1.96 |
Completeness [%] | 98.3 | 80.9 |
Redundancy | 8.5 | 2.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 289 | 100 mM Tris pH 8.5, 30 % PEG 10000, VAPOR DIFFUSION, SITTING DROP, temperature 289K |