7JP3
Des-B29,B30-insulin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-12-08 |
| Detector | Nonius Kappa CCD |
| Wavelength(s) | 0.97924 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 71.606, 60.001, 61.448 |
| Unit cell angles | 90.00, 95.17, 90.00 |
Refinement procedure
| Resolution | 37.800 - 1.950 |
| R-factor | 0.2155 |
| Rwork | 0.214 |
| R-free | 0.24920 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1xw7 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.382 |
| Data scaling software | SCALEPACK |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.980 |
| High resolution limit [Å] | 1.949 | 5.290 | 1.950 |
| Rmerge | 0.063 | 0.037 | 0.731 |
| Rmeas | 0.074 | 0.043 | 0.855 |
| Rpim | 0.038 | 0.023 | 0.440 |
| Number of reflections | 18729 | 979 | 913 |
| <I/σ(I)> | 8.7 | ||
| Completeness [%] | 98.8 | 99.2 | 98.3 |
| Redundancy | 3.8 | 3.6 | 3.7 |
| CC(1/2) | 0.997 | 0.609 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 298 | 1:2.5 ratio of Zn2+ to protein monomer in 0.02M Tris-HCl, 0.05M sodium citrate, 5% acetone, 0.03% phenol, 0.01% zinc acetate, PH 8.0 |
