1RU3
Crystal Structure of the monomeric acetyl-CoA synthase from Carboxydothermus hydrogenoformans
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-02-25 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.733, 1.7421, 1.47, 1.05 |
Spacegroup name | H 3 2 |
Unit cell lengths | 200.310, 200.310, 169.410 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 20.000 - 2.200 |
Rwork | 0.237 |
R-free | 0.27400 |
Structure solution method | MAD |
RMSD bond length | 0.016 * |
RMSD bond angle | 2.000 * |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | SHARP |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.300 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.049 * | |
Total number of observations | 301338 * | |
Number of reflections | 64871 | |
Completeness [%] | 97.6 * | 97.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.8 | 17 * | ammonium phosphate, pH 6.8, VAPOR DIFFUSION, HANGING DROP, temperature 290K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | reservoir | sodium-dithionite | 2 (mM) | pH6.8 |