7JQT
Abeta 16-36 beta-hairpin mimic with E22K Italian mutation
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 123.15 |
Detector technology | CCD |
Collection date | 2017-09-15 |
Detector | RIGAKU SATURN 944+ |
Wavelength(s) | 1.54 |
Spacegroup name | H 3 2 |
Unit cell lengths | 41.361, 41.361, 56.796 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 17.081 - 2.080 |
R-factor | 0.2075 |
Rwork | 0.202 |
R-free | 0.25720 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7jqr |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 17.081 | 2.154 |
High resolution limit [Å] | 2.080 | 2.080 |
Rmerge | 0.009 | 0.009 |
Number of reflections | 2159 | 125 |
<I/σ(I)> | 112.71 | |
Completeness [%] | 97.6 | |
Redundancy | 40.7 | |
CC(1/2) | 0.999 | 1.000 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 297.15 | sodium thiocyanate, PEG 3350 |