5KTV
Mis-pairing of unnatural base Z-G DNA duplex at pH 8.5
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I02 |
Synchrotron site | Diamond |
Beamline | I02 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-04-30 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.928190 |
Spacegroup name | H 3 |
Unit cell lengths | 40.924, 40.924, 102.147 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 34.050 - 2.350 |
R-factor | 0.18316 |
Rwork | 0.180 |
R-free | 0.23775 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 476d |
RMSD bond length | 0.007 |
RMSD bond angle | 1.739 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 33.480 |
High resolution limit [Å] | 2.300 |
Number of reflections | 2550 |
<I/σ(I)> | 2.3 |
Completeness [%] | 100.0 |
Redundancy | 11.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 291.15 | 100mM Sodium Chloride, 20mM Tris pH 8.5, 34% hexylene glycol, |