4CXL
Human insulin analogue (D-ProB8)-insulin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2012-12-16 |
Detector | DECTRIS PILATUS 2M |
Spacegroup name | I 21 3 |
Unit cell lengths | 78.660, 78.660, 78.660 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.330 - 1.500 |
R-factor | 0.1683 |
Rwork | 0.167 |
R-free | 0.19713 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1mso |
RMSD bond length | 0.033 |
RMSD bond angle | 2.784 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.330 | 1.540 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.050 | 0.660 |
Number of reflections | 13097 | |
<I/σ(I)> | 31.8 | 5 |
Completeness [%] | 100.0 | 100 |
Redundancy | 20 | 20 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8 | 0.1 M TRIS/HCL PH 8.0, 0.2 SODIUM CITRATE, 40% V/V MPD, PROTEIN CONCENTRATION 5MG/ML IN 20 MM HCL |