3JU3
Crystal structure of alpha chain of probable 2-oxoacid ferredoxin oxidoreductase from Thermoplasma acidophilum
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 | 2009-06-04 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97940 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 44.429, 65.528, 72.185 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.510 - 1.900 |
R-factor | 0.19958 |
Rwork | 0.198 |
R-free | 0.23631 |
Structure solution method | SAD |
RMSD bond length | 0.015 |
RMSD bond angle | 1.514 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | HKL-3000 |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.920 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.072 | 0.463 |
Number of reflections | 8590 | |
<I/σ(I)> | 41.64 | 4.33 |
Completeness [%] | 99.5 | 100 |
Redundancy | 6.9 | 6.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 289 | 2.1M DL-Malic acid pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 289K |