2AVH
G4T3G4 dimeric quadruplex structure
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 99 |
Detector technology | CCD |
Collection date | 2004-11-14 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.9792 |
Spacegroup name | C 2 2 2 |
Unit cell lengths | 29.932, 37.112, 43.653 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 23.300 - 1.500 |
R-factor | 0.199 |
Rwork | 0.198 |
R-free | 0.20800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | GGGG(+U)TTGGGG chain A (P21) |
RMSD bond length | 0.004 |
RMSD bond angle | 1.150 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | EPMR (2.5) |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.000 | 1.540 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.054 | |
Number of reflections | 4066 | |
Completeness [%] | 99.0 | 96.127 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 284.15 | sodium iodide, sodium cacodylate, PEG 400, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 284.15K |
Crystallization Reagents
ID | crystal ID | solution ID | reagent name | concentration | details |
1 | 1 | 1 | sodium iodide | ||
2 | 1 | 1 | sodium cacodylate | ||
3 | 1 | 1 | PEG 400 | ||
4 | 1 | 1 | H2O | ||
5 | 1 | 2 | sodium iodide | ||
6 | 1 | 2 | sodium cacodylate | ||
7 | 1 | 2 | PEG 400 | ||
8 | 1 | 2 | H2O |