3BQ0
Pre-insertion binary complex of Dbh DNA polymerase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X25 |
Synchrotron site | NSLS |
Beamline | X25 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-10-21 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9795 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 119.416, 119.416, 68.274 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.900 - 2.600 |
R-factor | 0.21711 |
Rwork | 0.214 |
R-free | 0.27904 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PDB entries 1IM4 and 1K1Q |
RMSD bond length | 0.009 |
RMSD bond angle | 1.246 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.640 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.048 | 0.314 |
Number of reflections | 14027 | |
<I/σ(I)> | 35.4 | 3.4 |
Completeness [%] | 89.3 | 81.4 |
Redundancy | 4.6 | 2.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | PEG-3350, calcium acetate, glycerol, HEPES, pH 7, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
Crystallization Reagents
ID | crystal ID | solution ID | reagent name | concentration | details |
1 | 1 | 1 | calcium acetate | ||
2 | 1 | 2 | calcium acetate | ||
3 | 1 | 1 | glycerol | ||
4 | 1 | 2 | glycerol | ||
5 | 1 | 1 | HEPES | ||
6 | 1 | 2 | HEPES |