6T7J
As-isolated Ni-free crystal structure of carbon monoxide dehydrogenase from Thermococcus sp. AM4 produced without CooC maturase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-12-14 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9184, 1.732, 1.479 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 268.138, 64.061, 100.600 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.320 - 2.430 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3b53 |
RMSD bond length | 0.009 |
RMSD bond angle | 0.875 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.16-3549) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.320 | 2.480 |
High resolution limit [Å] | 2.340 | 2.340 |
Number of reflections | 73992 | 11596 |
<I/σ(I)> | 8.19 | |
Completeness [%] | 99.3 | |
Redundancy | 6.61 | |
CC(1/2) | 0.997 | 0.978 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 291 | 0.1 M phosphate/citrate pH 4.2, 40% (w/v) polyethyleneglycol 300 |