3NCR
GlnK2 from Archaeoglubus fulgidus, ADP complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE X12 |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | X12 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.00 |
Spacegroup name | I 4 2 2 |
Unit cell lengths | 123.830, 123.830, 125.459 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.620 - 1.440 |
R-factor | 0.15899 |
Rwork | 0.157 |
R-free | 0.19950 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ncp |
RMSD bond length | 0.034 |
RMSD bond angle | 2.380 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.700 | 1.540 |
High resolution limit [Å] | 1.440 | 1.440 |
Rmerge | 0.094 | 0.699 |
Number of reflections | 88498 | |
<I/σ(I)> | 8.82 | 2.13 |
Completeness [%] | 99.8 | 98.8 |
Redundancy | 6.97 | 6.08 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 293 | ammonium phosphate, Tris-HCl, pH 5.6, VAPOR DIFFUSION, SITTING DROP, temperature 293K |