4CTJ
DENGUE 3 NS5 METHYLTRANSFERASE BOUND TO S-ADENOSYL METHIONINE AND FRAGMENT 3A9
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2011-06-10 |
Detector | MARRESEARCH |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 60.980, 185.430, 51.520 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 21.160 - 1.470 |
R-factor | 0.1568 |
Rwork | 0.155 |
R-free | 0.17970 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.010 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | BUSTER (2.11.5) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 92.720 | 1.480 |
High resolution limit [Å] | 1.470 | 1.470 |
Rmerge | 0.050 | 0.500 |
Number of reflections | 92163 | |
<I/σ(I)> | 17.4 | 2.3 |
Completeness [%] | 91.9 | 66.7 |
Redundancy | 3.6 | 3.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8.5 | pH 8.5 |