5JGA
Crystal structure of human TAK1/TAB1 fusion protein in complex with ligand 11c
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
Synchrotron site | Photon Factory |
Beamline | AR-NW12A |
Temperature [K] | 95 |
Detector technology | CCD |
Collection date | 2009-03-17 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 1.0000 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 58.009, 133.796, 141.374 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 97.180 - 2.000 |
R-factor | 0.1965 |
Rwork | 0.195 |
R-free | 0.22130 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2eva |
RMSD bond length | 0.010 |
RMSD bond angle | 1.353 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 97.180 | 50.000 | 2.070 |
High resolution limit [Å] | 2.000 | 4.310 | 2.000 |
Rmerge | 0.067 | 0.026 | 0.542 |
Number of reflections | 36658 | ||
<I/σ(I)> | 11.6 | ||
Completeness [%] | 97.8 | 99.6 | 87.9 |
Redundancy | 7.1 | 7 | 5.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.7 | 294 | 1.7M sodium potassium phosphate, 20%(v/v) Glycerol as cryoprotectant |