3KFV
Crystal structure of the SH3-kinase fragment of tight junction protein 3 (TJP3) in apo-form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-B |
Synchrotron site | APS |
Beamline | 23-ID-B |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-07-13 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.97942 |
Spacegroup name | P 4 2 2 |
Unit cell lengths | 88.654, 88.654, 92.311 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 44.327 - 2.800 |
R-factor | 0.225 |
Rwork | 0.222 |
R-free | 0.29000 |
Structure solution method | SAD |
RMSD bond length | 0.005 |
RMSD bond angle | 0.794 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SHELX |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 3.020 |
High resolution limit [Å] | 2.800 | 4.790 | 2.800 |
Rmerge | 0.155 | 0.071 | 0.834 |
Number of reflections | 9570 | ||
<I/σ(I)> | 5.7 | ||
Completeness [%] | 99.1 | 100 | 95.3 |
Redundancy | 12.9 | 13.4 | 8.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | 5% MPD, 1.4M ammonium sulfate, 0.1M HEPES, 0.01M ADP, pH 7.5, vapor diffusion, hanging drop, temperature 291K |