3LKZ
Structural and functional analyses of a conserved hydrophobic pocket of flavivirus methyltransferase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X4A |
Synchrotron site | NSLS |
Beamline | X4A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-06-15 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.0093 |
Spacegroup name | P 1 |
Unit cell lengths | 39.363, 65.740, 77.119 |
Unit cell angles | 112.01, 102.65, 90.19 |
Refinement procedure
Resolution | 38.880 - 2.000 |
R-factor | 0.229 |
Rwork | 0.229 |
R-free | 0.26900 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 2oy0 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.200 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.880 | 2.100 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.104 | 0.333 |
Number of reflections | 38704 | |
<I/σ(I)> | 5.3 | 2.2 |
Completeness [%] | 81.2 | 37.6 |
Redundancy | 1.8 | 1.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 298 | 13 TO 15% PEG4000, 5% ISOPROPANOL, 0.1M SODIUM CITRATE, PH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K |