2C57
H.pylori type II dehydroquinase in complex with FA1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX9.5 |
Synchrotron site | SRS |
Beamline | PX9.5 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-04-05 |
Detector | MARRESEARCH |
Spacegroup name | P 31 |
Unit cell lengths | 103.863, 103.863, 217.531 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 25.000 - 3.100 |
R-factor | 0.21 |
Rwork | 0.207 |
R-free | 0.23700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2c4w |
RMSD bond length | 0.024 |
RMSD bond angle | 2.076 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.600 | 3.150 |
High resolution limit [Å] | 3.080 | 3.100 |
Rmerge | 0.090 | 0.850 |
Number of reflections | 43781 | |
<I/σ(I)> | 10 | 1.2 |
Completeness [%] | 90.4 | 81.6 |
Redundancy | 4.5 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.8 | 10MG/ML PROTEIN AGAINST 30% 1,4 BUTANDIOL, 0.1M SODIUM ACETATE PH 4.5 USING SITTING DROP METHOD |