3KVB
Structure of KIAA1718 Jumonji domain in complex with N-oxalylglycine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-BM |
Synchrotron site | APS |
Beamline | 22-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-08-06 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.0 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 78.300, 78.300, 289.100 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 33.670 - 2.690 |
Rwork | 0.216 |
R-free | 0.26700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3kv6 |
RMSD bond length | 0.006 |
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] | 33.670 | 2.790 |
High resolution limit [Å] | 2.690 | 2.690 |
Rmerge | 0.085 | 0.394 |
Number of reflections | 15320 | |
<I/σ(I)> | 13.3 | 2.6 |
Completeness [%] | 98.3 | 86.3 |
Redundancy | 14.4 | 8 |
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 |