1N63
Crystal Structure of the Cu,Mo-CO Dehydrogenase (CODH); Carbon monoxide reduced state
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MPG/DESY, HAMBURG BEAMLINE BW6 |
Synchrotron site | MPG/DESY, HAMBURG |
Beamline | BW6 |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 1999-07-14 |
Detector | MARRESEARCH |
Wavelength(s) | 1.05 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 118.962, 131.270, 159.648 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 17.000 - 1.210 |
R-factor | 0.151 |
Rwork | 0.149 |
R-free | 0.18500 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.019 * |
RMSD bond angle | 1.916 * |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 17.000 | 1.250 |
High resolution limit [Å] | 1.210 | 1.210 |
Rmerge | 0.073 * | |
Total number of observations | 2234419 * | |
Number of reflections | 707024 | |
Completeness [%] | 94.1 | 79.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion * | 7.3 | 281 | Dobbek, H., (1999) Proc.Natl.Acad.Sci.USA, 96, 8884. * |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | 1 | 0.8 (M) | ||
2 | 1 | 1 | 0.8 (M) | ||
3 | 1 | 1 | MPD | 2 (%) | |
4 | 1 | 1 | HEPES | 100 (mM) | pH7.3 |