3EPG
Structure of Human DNA Polymerase Iota complexed with N2-ethylguanine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2006-11-21 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.5418 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 98.535, 98.535, 202.354 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 15.000 - 2.500 |
R-factor | 0.23671 |
Rwork | 0.234 |
R-free | 0.28284 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2ALZ minus DNA |
RMSD bond length | 0.015 |
RMSD bond angle | 1.806 |
Data reduction software | d*TREK |
Data scaling software | d*TREK |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 15.000 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.122 | 0.400 |
Number of reflections | 19625 | |
<I/σ(I)> | 13 | 5.1 |
Completeness [%] | 98.9 | 90.6 |
Redundancy | 17.77 | 11.73 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277.15 | 12-15% PEG MME 5000, 0.2-0.4M Ammonium Sulfate, 0.1M MES, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 277.15K |
Crystallization Reagents
ID | crystal ID | solution ID | reagent name | concentration | details |
1 | 1 | 1 | PEG MME 5000 | ||
2 | 1 | 1 | Ammonium Sulfate | ||
3 | 1 | 1 | MES | ||
4 | 1 | 2 | PEG MME 5000 | ||
5 | 1 | 2 | Ammonium Sulfate | ||
6 | 1 | 2 | MES |