1CVX
CRYSTAL STRUCTURE OF POLYAMIDE DIMER (IMPYHPPYBETADP)2 BOUND TO B-DNA DECAMER CCAGATCTGG
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 103 |
Detector technology | IMAGE PLATE |
Detector | RIGAKU RAXIS IV |
Spacegroup name | P 31 |
Unit cell lengths | 34.200, 34.200, 46.100 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 17.000 - 2.270 |
R-factor | 0.237 |
Rwork | 0.237 |
R-free | 0.23800 |
RMSD bond length | 0.020 |
RMSD bond angle | 2.100 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 17.000 | 2.350 |
High resolution limit [Å] | 2.270 | 2.270 |
Rmerge | 0.023 | 0.204 |
Total number of observations | 7261 * | |
Number of reflections | 2680 | |
<I/σ(I)> | 42.3 | |
Completeness [%] | 96.1 | 87 |
Redundancy | 2.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 * | 4 * | CALCIUM ACETATE, TRIS, MPD, pH 8.1, VAPOR DIFFUSION, SITTING DROP, temperature 277.0K |
Crystallization Reagents
ID | crystal ID | solution ID | reagent name | concentration | details |
1 | 1 | 1 | CALCIUM ACETATE | ||
2 | 1 | 1 | TRIS | ||
3 | 1 | 1 | MPD | ||
4 | 1 | 2 | MPD |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | duplex DNA | 0.6 (mM) | |
2 | 1 | drop | polyamide | 1.3 (mM) | |
3 | 1 | drop | 12 (%) | ||
4 | 1 | drop | Ca acetate | 35 (mM) | |
5 | 1 | drop | Tris-HCl | 10 (mM) | |
6 | 1 | reservoir | MPD | 25 (%) |