6BLQ
Crystal Structure of IAg7 in complex with insulin mimotope p8E9E
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-C |
| Synchrotron site | APS |
| Beamline | 24-ID-C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-01-23 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.979500 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 39.274, 112.733, 62.172 |
| Unit cell angles | 90.00, 107.32, 90.00 |
Refinement procedure
| Resolution | 40.872 - 1.800 |
| R-factor | 0.1702 |
| Rwork | 0.168 |
| R-free | 0.20310 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5dmk |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.875 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.840 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.070 | 0.480 |
| Number of reflections | 44763 | |
| <I/σ(I)> | 12.5 | |
| Completeness [%] | 99.8 | |
| Redundancy | 5.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 298 | 20% PEG3350, 100mM sodium citrate at pH5.0, 5% isopropanol |
