6L8Q
Complex structure of bat CD26 and MERS-RBD
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 291 |
Detector technology | CCD |
Collection date | 2016-06-11 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.979 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 114.657, 273.674, 115.234 |
Unit cell angles | 90.00, 119.68, 90.00 |
Refinement procedure
Resolution | 49.810 - 3.100 |
R-factor | 0.202 |
Rwork | 0.200 |
R-free | 0.24060 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4kr0 |
RMSD bond length | 0.004 |
RMSD bond angle | 0.651 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX (1.16_3549) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.210 |
High resolution limit [Å] | 3.097 | 3.100 |
Number of reflections | 95308 | 11097 |
<I/σ(I)> | 8.463 | |
Completeness [%] | 85.3 | |
Redundancy | 5.7 | |
CC(1/2) | 0.972 | 0.738 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.2M imidazole malate, pH 8.5, 7.5% (w/v) PEG 10000 |