3HIX
Crystal Structure of the Rhodanese_3 like domain from Anabaena sp Alr3790 protein. Northeast Structural Genomics Consortium Target NsR437i
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL11-1 |
Synchrotron site | SSRL |
Beamline | BL11-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-05-15 |
Detector | MARMOSAIC 325 mm CCD |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 62.306, 105.479, 41.615 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.610 - 1.920 |
R-factor | 0.215 |
Rwork | 0.214 |
R-free | 0.23000 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.332 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELXDE |
Refinement software | PHENIX ((phenix.refine)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 500.000 | |
High resolution limit [Å] | 1.920 | 1.920 |
Rmerge | 0.086 | 0.529 |
Number of reflections | 21563 | |
<I/σ(I)> | 37.6 | 3.9 |
Completeness [%] | 99.5 | 95.5 |
Redundancy | 14.2 | 11.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6 | 277 | 20% PEG 4000, 0.1M manganese chloride, 0.1M MES, pH 6.0, Microbatch under paraffin oil, temperature 277K |