2O8D
human MutSalpha (MSH2/MSH6) bound to ADP and a G dU mispair
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.9793 |
Spacegroup name | P 43 3 2 |
Unit cell lengths | 260.379, 260.379, 260.379 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 3.000 |
R-factor | 0.241 |
Rwork | 0.239 |
R-free | 0.27800 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.007 |
RMSD bond angle | 1.342 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | REFMAC (5.2.005) |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.250 |
High resolution limit [Å] | 3.000 | 3.000 |
Rmerge | 0.093 | 0.584 |
Number of reflections | 60518 | |
<I/σ(I)> | 12.22 | 3.2 |
Completeness [%] | 99.8 | 100 |
Redundancy | 6 | 6.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7 | 290 | 11% PEG 8000, 10 mM magnesium sulfate, 100 mM bis-tris-propane, pH 7, VAPOR DIFFUSION, temperature 290K |
Crystallization Reagents
ID | crystal ID | solution ID | reagent name | concentration | details |
1 | 1 | 1 | PEG 8000 | ||
2 | 1 | 1 | magnesium sulfate | ||
3 | 1 | 1 | bis-tris-propane | ||
4 | 1 | 1 | HOH | ||
5 | 1 | 2 | PEG 8000 | ||
6 | 1 | 2 | magnesium sulfate | ||
7 | 1 | 2 | bis-tris-propane | ||
8 | 1 | 2 | HOH |