8ONR
Crystal structure of human insulin trans-HypB26-DTI analogue
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04-1 |
Synchrotron site | Diamond |
Beamline | I04-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-12-15 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 0.91188 |
Spacegroup name | I 4 2 2 |
Unit cell lengths | 57.970, 57.970, 55.820 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.210 - 1.880 |
R-factor | 0.26016 |
Rwork | 0.257 |
R-free | 0.31184 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.472 |
Data reduction software | xia2 |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0405) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.210 | 1.930 |
High resolution limit [Å] | 1.880 | 1.880 |
Rmerge | 0.097 | |
Rpim | 0.027 | 0.646 |
Number of reflections | 4082 | 285 |
<I/σ(I)> | 15.8 | 1.2 |
Completeness [%] | 99.5 | 99.2 |
Redundancy | 15.2 | |
CC(1/2) | 0.991 | 0.734 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.2 | 292 | 0.3M Na2SO4 0.3M Tris pH 8.2 0.6mM ZnAc 0.06% Phenol |