7V1F
Crystal structure of Omsk hemorrhagic fever virus NS5 MTase (in complex with SAM and GTP)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-11-08 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.9792 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 34.797, 88.059, 42.664 |
Unit cell angles | 90.00, 90.75, 90.00 |
Refinement procedure
Resolution | 34.790 - 2.000 |
R-factor | 0.1733 |
Rwork | 0.172 |
R-free | 0.20610 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4k6m |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.19) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.070 |
High resolution limit [Å] | 2.000 | 4.310 | 2.000 |
Rmerge | 0.071 | 0.033 | 0.440 |
Rmeas | 0.087 | 0.041 | 0.539 |
Rpim | 0.050 | 0.024 | 0.308 |
Total number of observations | 48120 | ||
Number of reflections | 16777 | 1682 | 1703 |
<I/σ(I)> | 8.6 | ||
Completeness [%] | 97.3 | 95.7 | 98.4 |
Redundancy | 2.9 | 2.8 | 2.8 |
CC(1/2) | 0.994 | 0.763 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 5.6 | 289 | isopropanol, trisodium citrate, PEG 4000, glycerol |