3QCR
Incomplete structural model of a human telomeric DNA quadruplex-acridine complex.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-06-28 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9763 |
Spacegroup name | P 62 2 2 |
Unit cell lengths | 71.674, 71.674, 29.370 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 9.960 - 3.200 |
R-factor | 0.34595 |
Rwork | 0.344 |
R-free | 0.37837 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1k8p |
RMSD bond length | 0.006 |
RMSD bond angle | 0.990 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.370 | 3.260 |
High resolution limit [Å] | 3.160 | 3.160 |
Rmerge | 0.102 | 0.115 |
Number of reflections | 1104 | |
<I/σ(I)> | 19.9 | |
Completeness [%] | 97.5 | 100 |
Redundancy | 16.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 285 | MPD, KCl, Na cacodylate, spermine, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 285K |