3KVA
Structure of KIAA1718 Jumonji domain in complex with alpha-ketoglutarate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-04-20 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.27046 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 78.100, 78.100, 290.800 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 34.400 - 2.790 |
Rwork | 0.203 |
R-free | 0.26900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3kv6 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.300 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | CNS (1.2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 34.400 | 2.890 |
High resolution limit [Å] | 2.790 | 2.790 |
Rmerge | 0.088 | 0.381 |
Number of reflections | 26944 | |
<I/σ(I)> | 15.5 | 4.1 |
Completeness [%] | 99.5 | 99.3 |
Redundancy | 7 | 7.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.4 | 289 | 17-20% (v/v) polyethylene glycol 5000 MME, 0.2 M CaCl2, and 0.1 M BisTris pH 6.4, VAPOR DIFFUSION, HANGING DROP, temperature 289K |