8IIS
MsmUdgX H109S/R184A double mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | BRUKER AXS MICROSTAR |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2021-04-23 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.54179 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 36.360, 51.650, 54.580 |
Unit cell angles | 90.00, 105.00, 90.00 |
Refinement procedure
Resolution | 23.480 - 1.610 |
R-factor | 0.1538 |
Rwork | 0.153 |
R-free | 0.17030 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.019 |
RMSD bond angle | 1.746 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.110 | 1.630 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.040 | 0.059 |
Rmeas | 0.051 | 0.076 |
Rpim | 0.031 | 0.046 |
Number of reflections | 24280 | 831 |
<I/σ(I)> | 28.2 | 16.8 |
Completeness [%] | 94.3 | 66.2 |
Redundancy | 4.9 | 4.2 |
CC(1/2) | 0.996 | 0.985 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICROBATCH | 7 | 295 | 2.0M Ammonium citrate tribasic pH7.0, 0.1M BIS-TRIS propane pH7.0 |