5ZU7
Crystal structure of MERS-CoV macro domain in complex with AMP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE BL13B1 |
Synchrotron site | NSRRC |
Beamline | BL13B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-04-19 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.00000 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 41.370, 39.526, 45.515 |
Unit cell angles | 90.00, 102.37, 90.00 |
Refinement procedure
Resolution | 29.540 - 1.705 |
R-factor | 0.1599 |
Rwork | 0.157 |
R-free | 0.19080 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5dus |
RMSD bond length | 0.006 |
RMSD bond angle | 0.830 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.540 | 1.760 |
High resolution limit [Å] | 1.700 | 1.700 |
Number of reflections | 39892 | |
<I/σ(I)> | 14.941 | 2.012 |
Completeness [%] | 96.8 | 95.5 |
Redundancy | 2.6 | 2.4 |
CC(1/2) | 0.770 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 283 | 1.6M Sodium citrate, 0.1M HEPES sodium pH 7.5 |