Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 93 |
Detector technology | PIXEL |
Collection date | 2016-08-04 |
Detector | DECTRIS PILATUS 2M-F |
Wavelength(s) | 1.0 |
Spacegroup name | P 31 |
Unit cell lengths | 130.430, 130.430, 221.770 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 49.770 - 2.450 |
Rwork | 0.161 |
R-free | 0.19680 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4fmg |
RMSD bond length | 0.007 |
RMSD bond angle | 1.534 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0253) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.770 | 2.538 |
High resolution limit [Å] | 2.450 | 2.450 |
Rmeas | 0.086 | 0.526 |
Number of reflections | 147085 | 13659 |
<I/σ(I)> | 21.58 | 4.69 |
Completeness [%] | 94.8 | |
Redundancy | 8.3 | |
CC(1/2) | 0.998 | 0.929 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | KSCN, PEG 3350 |