8QDJ
Ntaya virus methyltransferase in complex wih Sinefungin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-07-01 |
Detector | DECTRIS PILATUS 300K |
Wavelength(s) | 1.54187 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 38.389, 71.092, 50.445 |
Unit cell angles | 90.00, 92.70, 90.00 |
Refinement procedure
Resolution | 26.070 - 1.800 |
R-factor | 0.1757 |
Rwork | 0.173 |
R-free | 0.20860 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 0.770 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 26.070 | 1.864 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.199 | 0.335 |
Rmeas | 0.281 | 0.474 |
Rpim | 0.199 | 0.335 |
Number of reflections | 25149 | 2492 |
<I/σ(I)> | 16.35 | 2.11 |
Completeness [%] | 99.8 | 99.96 |
Redundancy | 2 | 2 |
CC(1/2) | 0.878 | 0.790 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 291 | 0.2 M Magnesium chloride hexahydrate, 0.1 M Bis-Tri 5.5, 25 % PEG 3350 |