2RJM
3Ig structure of titin domains I67-I69 E-to-A mutated variant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-07-02 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.008 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 85.280, 86.480, 44.410 |
Unit cell angles | 90.00, 104.94, 90.00 |
Refinement procedure
Resolution | 18.000 - 2.000 |
R-factor | 0.179 |
Rwork | 0.176 |
R-free | 0.22800 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 2rik |
RMSD bond length | 0.016 |
RMSD bond angle | 1.599 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | CCP4 |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 18.000 | 2.020 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.080 | 0.472 |
Number of reflections | 20955 | 533 |
<I/σ(I)> | 13.77 | 3.2 |
Completeness [%] | 99.2 | 84.3 |
Redundancy | 3.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 298 | pH 4.6, vapor diffusion, hanging drop, temperature 298K |