5F1W
Crystal structure of the enantiomer of a macrocyclic peptide containing fragments from alpha synuclein 36-55
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.1 |
Synchrotron site | ALS |
Beamline | 8.2.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-05-02 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.997 |
Spacegroup name | P 21 3 |
Unit cell lengths | 77.910, 77.910, 77.910 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.842 - 2.161 |
R-factor | 0.2291 |
Rwork | 0.223 |
R-free | 0.28280 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5f1t |
RMSD bond length | 0.005 |
RMSD bond angle | 1.058 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 34.842 |
High resolution limit [Å] | 2.161 |
Number of reflections | 8669 |
<I/σ(I)> | 5.84 |
Completeness [%] | 100.0 |
Redundancy | 2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 296 | 0.1 M HEPES (pH 8.0), 0.5 m ammonium sulphate, 34% 2-methyl-2,4-pentanediol |