1VCE
Crystal structure of project ID PH0725 from Pyrococcus horikoshii OT3
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL26B1 |
Synchrotron site | SPring-8 |
Beamline | BL26B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-02-17 |
Detector | RIGAKU JUPITER |
Wavelength(s) | 0.97938 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 104.721, 104.721, 138.672 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.210 - 2.100 |
R-factor | 0.218 |
Rwork | 0.218 |
R-free | 0.25300 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.300 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.180 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.061 | 0.540 |
Number of reflections | 45662 | |
<I/σ(I)> | 13.3 | 3.85 |
Completeness [%] | 100.0 | 100 |
Redundancy | 13.6 | 14 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | microbach | 5.5 | 291 | 3.85M Na Formate, 0.1M Acetate, pH 5.5, microbach, temperature 291K |