4L6C
Crystal structure of human mitochondrial deoxyribonucleotidase in complex with the inhibitor pib-t
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-06-01 |
Detector | MARMOSAIC 225 mm CCD |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 73.810, 73.810, 105.510 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.836 - 1.800 |
R-factor | 0.151 |
Rwork | 0.150 |
R-free | 0.17200 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.021 |
RMSD bond angle | 2.120 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 34.836 | 1.850 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.585 | |
Number of reflections | 27645 | |
<I/σ(I)> | 23.6 | 1.3 |
Completeness [%] | 100.0 | 99.9 |
Redundancy | 16.1 | 16 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.2 | 293 | 8% PEG 8000, 20MM DIHYDROGEN POTASSIUM PHOSPHATE, 10% GLYCEROL, pH 4.2, VAPOR DIFFUSION, HANGING DROP, temperature 293K |