3HB7
The Crystal Structure of an Isochorismatase-like Hydrolase from Alkaliphilus metalliredigens to 2.3A
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 | 2009-04-06 |
Detector | ADSC QUANTUM 315 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 85.651, 105.425, 106.267 |
Unit cell angles | 90.00, 103.90, 90.00 |
Refinement procedure
Resolution | 46.320 - 2.300 |
R-factor | 0.198 |
Rwork | 0.196 |
R-free | 0.23800 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.252 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | HKL-3000 |
Refinement software | REFMAC (refmac_5.5.0054) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.380 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.069 | 0.252 |
Number of reflections | 80891 | |
<I/σ(I)> | 13.5 | |
Completeness [%] | 99.6 | 99.7 |
Redundancy | 3.8 | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.6 | 298 | 25% PEG 3350, 0.2M Ammonium acetate, 0.1M Tris pH 7.6, VAPOR DIFFUSION, temperature 298K |