7JQU
Abeta 16-36 beta-hairpin mimic with E22G Arctic mutation
This is a non-PDB format compatible entry.
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 | 2017-02-15 |
Detector | RIGAKU SATURN 944+ |
Wavelength(s) | 1.54 |
Spacegroup name | P 4 3 2 |
Unit cell lengths | 67.341, 67.341, 67.341 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 23.809 - 2.611 |
R-factor | 0.2475 |
Rwork | 0.243 |
R-free | 0.28110 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5w4h |
RMSD bond length | 0.004 |
RMSD bond angle | 0.797 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 23.810 | 2.705 |
High resolution limit [Å] | 2.611 | 2.611 |
Rmerge | 0.012 | 0.245 |
Number of reflections | 3025 | 179 |
<I/σ(I)> | 23.04 | |
Completeness [%] | 99.4 | |
Redundancy | 93.3 | |
CC(1/2) | 1.000 | 0.658 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 297.15 | sodium citrate, isopropanol, PEG 4000 |