2P62
Crystal structure of hypothetical protein PH0156 from Pyrococcus horikoshii OT3
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-01-30 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.97928 |
Spacegroup name | P 61 |
Unit cell lengths | 122.071, 122.071, 109.067 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 40.670 - 2.500 |
Rwork | 0.213 |
R-free | 0.24400 |
Structure solution method | SAD |
RMSD bond length | 0.007 |
RMSD bond angle | 1.158 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SGXPRO |
Refinement software | CNS |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.590 |
High resolution limit [Å] | 2.500 | 5.380 | 2.500 |
Rmerge | 0.071 | 0.221 | |
Number of reflections | 31973 | ||
<I/σ(I)> | 19 | ||
Completeness [%] | 100.0 | 99.9 | 100 |
Redundancy | 10.5 | 9.2 | 11.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.8 | 293 | USING 1 MICROLITER DROPS CONTAINING EQUAL VOLUMES OF PROTEIN CONCENTRATE (10.0 mg/ml) AND RESERVOIR SOLUTION CONTAINING 24% v/v MPD, 0.1M Sodium acetate (pH 4.8), 0.1M Magnesium chloride, VAPOR DIFFUSION, SITTING DROP, temperature 293K |