4HG3
Structural insights into yeast Nit2: wild-type yeast Nit2 in complex with alpha-ketoglutarate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-05-15 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97907 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 65.211, 125.653, 77.964 |
Unit cell angles | 90.00, 95.30, 90.00 |
Refinement procedure
Resolution | 48.840 - 1.930 |
R-factor | 0.19833 |
Rwork | 0.197 |
R-free | 0.22675 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4h5u |
RMSD bond length | 0.007 |
RMSD bond angle | 1.006 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.960 |
High resolution limit [Å] | 1.930 | 1.930 |
Rmerge | 0.687 | |
Number of reflections | 92897 | |
<I/σ(I)> | 2.6 | |
Completeness [%] | 100.0 | 100 |
Redundancy | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 287 | 17.5% PEG4000, 0.1M sodium cacodylate, 25mM 2-oxoglutaric acid sodium salt, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 287K |