7VUK
Crystal Structure of the core region of Thermus thermophilus MutS2 complexed with ADP.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL38B1 |
Synchrotron site | SPring-8 |
Beamline | BL38B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-05-16 |
Detector | RAYONIX MX225HE |
Wavelength(s) | 1.00000 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 133.654, 133.654, 197.461 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.370 - 3.380 |
R-factor | 0.2671 |
Rwork | 0.267 |
R-free | 0.27240 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7vuf |
RMSD bond length | 0.003 |
RMSD bond angle | 0.690 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX (1.19.2) |
Refinement software | PHENIX (1.19.2) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 3.450 |
High resolution limit [Å] | 3.380 | 8.670 | 3.380 |
Rmerge | 0.315 | 0.072 | 3.226 |
Rmeas | 0.411 | 0.075 | 3.372 |
Rpim | 0.154 | 0.022 | 0.970 |
Number of reflections | 30328 | 1690 | 1508 |
<I/σ(I)> | 6.9 | ||
Completeness [%] | 100.0 | 99.2 | 100 |
Redundancy | 12.2 | 11.5 | 11.6 |
CC(1/2) | 0.998 | 0.432 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 293 | 50 mM Tris-HCl (pH 8.5), 2.5 mM magnesium sulfate, 1.45 M 1,6-hexanediol, 2.5 mM ADP |