7S4Y
Serial Macromolecular Crystallography at ALBA Synchrotron Light Source - Insulin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALBA BEAMLINE XALOC |
Synchrotron site | ALBA |
Beamline | XALOC |
Temperature [K] | 298 |
Detector technology | PIXEL |
Collection date | 2019-06-08 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.27819 |
Spacegroup name | H 3 |
Unit cell lengths | 81.600, 81.600, 33.600 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 24.350 - 1.710 |
R-factor | 0.24199 |
Rwork | 0.240 |
R-free | 0.25774 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4ey9 |
RMSD bond length | 0.005 |
RMSD bond angle | 1.077 |
Data reduction software | CrystFEL (v0.10.0) |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.300 | 1.760 |
High resolution limit [Å] | 1.700 | 1.700 |
Number of reflections | 9140 | 928 |
<I/σ(I)> | 7.9 | 1.5 |
Completeness [%] | 100.0 | 100 |
Redundancy | 1292 | 881 |
CC(1/2) | 0.979 | 0.367 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | BATCH MODE | 298 | insulin was dissolved in 5 mM zinc chloride, 25 mM HCl at a concentration of 5-10 mg/ml. Cuboid-shaped microcrystals were obtained in 35.2 mM sodium citrate pH 7, and 5% (v/v) acetone as precipitant |