4UI4
Crystal structure of human tankyrase 2 in complex with TA-29
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-02-25 |
Detector | DECTRIS PIXEL |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 93.220, 97.080, 117.410 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.970 - 2.400 |
R-factor | 0.17506 |
Rwork | 0.172 |
R-free | 0.23059 |
Structure solution method | OTHER |
Starting model (for MR) | NONE |
RMSD bond length | 0.011 |
RMSD bond angle | 1.414 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.460 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.140 | 0.930 |
Number of reflections | 21148 | |
<I/σ(I)> | 13.4 | 2.15 |
Completeness [%] | 99.8 | 99.9 |
Redundancy | 6.2 | 6.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8.5 | 0.2 M LISO4, 0.1 M TRIS HCL, 22% PEG3350, PH 8.5 |