412D
DUPLEX [5'-D(GCGTA+TACGC)]2 WITH INCORPORATED 2'-O-METHYL-[TRI(OXYETHYL)] RIBONUCLEOSIDE
Experimental procedure
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 1996-11-11 |
Detector | RIGAKU RAXIS II |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 24.640, 43.620, 45.470 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 8.000 - 1.650 |
R-factor | 0.189 |
Rwork | 0.189 |
R-free | 0.22000 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.360 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | X-PLOR (3.851) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 21.800 |
High resolution limit [Å] | 1.650 |
Rmerge | 0.080 |
Number of reflections | 6142 |
Completeness [%] | 97.8 |
Redundancy | 5.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.3 | pH 6.30, VAPOR DIFFUSION, SITTING DROP | |
1 | VAPOR DIFFUSION, SITTING DROP | 6.3 | pH 6.30, VAPOR DIFFUSION, SITTING DROP | |
1 | VAPOR DIFFUSION, SITTING DROP | 6.3 | pH 6.30, VAPOR DIFFUSION, SITTING DROP | |
1 | VAPOR DIFFUSION, SITTING DROP | 6.3 | pH 6.30, VAPOR DIFFUSION, SITTING DROP |
Crystallization Reagents
ID | crystal ID | solution ID | reagent name | concentration | details |
1 | 1 | 1 | SODIUM CACODYLATE | ||
2 | 1 | 1 | MGCL2 | ||
3 | 1 | 1 | SPERMINE | ||
4 | 1 | 2 | MPD |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | oligonucleotide | 1.2 (mM) | |
2 | 1 | drop | sodium cacodylate | 30 (mM) | |
3 | 1 | drop | 8 (mM) | ||
4 | 1 | drop | spermine tetrahydrochloride | 20 (mM) | |
5 | 1 | reservoir | MPD | 40 (%(v/v)) |