2WRU
Semi-synthetic highly active analogue of human insulin NMeAlaB26-DTI- NH2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-12-03 |
| Detector | ADSC CCD |
| Spacegroup name | I 41 2 2 |
| Unit cell lengths | 38.721, 38.721, 123.148 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 36.940 - 1.570 |
| R-factor | 0.18207 |
| Rwork | 0.179 |
| R-free | 0.25474 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1mso |
| RMSD bond length | 0.022 |
| RMSD bond angle | 1.744 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0082) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.630 |
| High resolution limit [Å] | 1.570 | 1.570 |
| Rmerge | 0.060 | 0.160 |
| Number of reflections | 7028 | |
| <I/σ(I)> | 23 | 11 |
| Completeness [%] | 95.0 | 61.6 |
| Redundancy | 10.6 | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 3 | 0.32 M NA2SO4, PH 3.0 |
