2ZV3
Crystal structure of project MJ0051 from Methanocaldococcus jannaschii DSM 2661
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 4A |
Synchrotron site | PAL/PLS |
Beamline | 4A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-02-09 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.0 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 149.850, 70.790, 96.010 |
Unit cell angles | 90.00, 121.67, 90.00 |
Refinement procedure
Resolution | 40.920 - 2.100 |
R-factor | 0.218 |
Rwork | 0.218 |
R-free | 0.26300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1wn2 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.300 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.180 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.080 | 0.358 |
Number of reflections | 49935 | |
<I/σ(I)> | 8.8 | 3.4 |
Completeness [%] | 99.6 | 97.8 |
Redundancy | 4.8 | 4.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Oil microbach | 4.6 | 295 | 30w/v(%) PEG 4000, 0.1M Acetate, 0.2M Ammonium Acetate, pH 4.6, Oil microbach, temperature 295K |