6LSE
Crystal structure of the enterovirus 71 polymerase elongation complex (C3S6A/C3S6B form)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-07-16 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9789 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 62.607, 77.015, 156.679 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.580 - 2.250 |
R-factor | 0.2013 |
Rwork | 0.199 |
R-free | 0.24020 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5f8l |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (v1.14) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.330 |
High resolution limit [Å] | 2.250 | 4.850 | 2.250 |
Rmerge | 0.082 | 0.058 | 0.519 |
Rmeas | 0.092 | 0.066 | 0.595 |
Rpim | 0.040 | 0.029 | 0.283 |
Total number of observations | 140354 | ||
Number of reflections | 32014 | 3401 | 2717 |
<I/σ(I)> | 8.6 | ||
Completeness [%] | 87.2 | 86.9 | 75.2 |
Redundancy | 4.4 | 4.4 | 3.6 |
CC(1/2) | 0.994 | 0.773 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 6.5 | 289 | MES, PEG 5000 monomethyl ether, glycerol |