3WSE
Reduced HcgD from Methanocaldococcus jannaschii
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2012-11-13 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 1.000 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 95.010, 134.980, 161.620 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.577 - 2.500 |
R-factor | 0.1955 |
Rwork | 0.194 |
R-free | 0.22140 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2fyw |
RMSD bond length | 0.004 |
RMSD bond angle | 0.764 |
Data scaling software | XSCALE |
Phasing software | EPMR |
Refinement software | PHENIX (1.8.4_1496) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.600 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.091 | 0.733 |
Number of reflections | 72437 | |
<I/σ(I)> | 16.84 | 3.12 |
Completeness [%] | 99.8 | 99.7 |
Redundancy | 5.852 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.2 | 298 | 10%(w/v) PEG8000, 0.2M NaCl, 0.1M Na/K phosphate, 5mM sodium dithionite, pH 6.2, VAPOR DIFFUSION, SITTING DROP, temperature 298K |