3RRH
Ternary Structure of the large fragment of Taq DNA polymerase bound to an abasic site and a ddTTP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2010-10-15 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 1.0000 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 108.305, 108.305, 90.151 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.897 - 1.800 |
R-factor | 0.1681 |
Rwork | 0.166 |
R-free | 0.20060 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3lwl |
RMSD bond length | 0.006 |
RMSD bond angle | 1.003 |
Data scaling software | XDS |
Phasing software | PHENIX (dev_613) |
Refinement software | PHENIX ((phenix.refine: dev_613)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.900 |
High resolution limit [Å] | 1.800 | 1.790 |
Rmerge | 0.097 | 1.200 |
<I/σ(I)> | 15.23 | 2.12 |
Completeness [%] | 99.5 | 96.9 |
Redundancy | 9.95 | 9.82 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | 0.05 M Na cacodylate pH 6.5, 0.2 M NH4OAc, 0.01 M Mg(OAc)2, 28% PEG 8000, VAPOR DIFFUSION, HANGING DROP, temperature 291K |