2P41
Crystal Structure of Dengue Methyltransferase in Complex with 7MeGpppG2'OMe and S-Adenosyl-L-homocysteine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 100 |
Collection date | 2002-12-14 |
Wavelength(s) | 0.933 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 108.394, 108.394, 55.890 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 36.660 - 1.801 |
R-factor | 0.16469 |
Rwork | 0.163 |
R-free | 0.19588 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1l9k |
RMSD bond length | 0.012 |
RMSD bond angle | 1.542 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | AMoRE |
Refinement software | REFMAC (5.2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.900 | 1.900 |
High resolution limit [Å] | 1.800 | 1.800 |
Number of reflections | 35115 | |
<I/σ(I)> | 37.6 | 6.1 |
Completeness [%] | 99.5 | 97.3 |
Redundancy | 6.9 | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.8 | 293 | 0.4 M Ammonium Sulfate, 0.1 M Sodium Citrate, 1.2 M Lithium Sulfate, pH 5.8, VAPOR DIFFUSION, HANGING DROP, temperature 293K |