8IIE
Complex form of MsmUdgX and uracil- obtained from uracil DNA (ttUtt) post its cleavage by MsmUdgX
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | BRUKER AXS MICROSTAR |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2021-09-17 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.54179 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 36.420, 51.330, 55.140 |
Unit cell angles | 90.00, 104.98, 90.00 |
Refinement procedure
Resolution | 23.640 - 1.670 |
R-factor | 0.1598 |
Rwork | 0.158 |
R-free | 0.18790 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.017 |
RMSD bond angle | 1.399 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.20) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.020 | 1.690 |
High resolution limit [Å] | 1.670 | 1.670 |
Rmerge | 0.050 | 0.287 |
Rmeas | 0.064 | 0.383 |
Rpim | 0.040 | 0.251 |
Number of reflections | 22686 | 864 |
<I/σ(I)> | 17.9 | 4.6 |
Completeness [%] | 98.0 | 75.1 |
Redundancy | 4.8 | 3.9 |
CC(1/2) | 0.996 | 0.598 |
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 |