5OPO
Crystal structure of R238G cN-II mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.3 |
Synchrotron site | BESSY |
Beamline | 14.3 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-03-16 |
Detector | RAYONIX MX-225 |
Wavelength(s) | 0.894 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 91.612, 126.862, 130.572 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.430 - 2.000 |
R-factor | 0.1721 |
Rwork | 0.171 |
R-free | 0.20330 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5k7y |
RMSD bond length | 0.012 |
RMSD bond angle | 1.512 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.430 | 2.090 |
High resolution limit [Å] | 1.969 | 1.970 |
Rmerge | 0.099 | 0.751 |
Rmeas | 0.112 | 0.849 |
Number of reflections | 54032 | 8599 |
<I/σ(I)> | 13.6 | 1.98 |
Completeness [%] | 99.8 | 99.3 |
Redundancy | 4.6 | 4.58 |
CC(1/2) | 0.998 | 0.703 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293 | 0.1 M MOPS/HEPES-Na pH 7.5; 0.03 M of each divalent cation ; 10% w/v PEG 4000, 20% v/v glycerol A7 Morpheus condition |