6H47
Human KRAS in complex with darpin K19
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-04-22 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.976 |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 85.829, 85.829, 227.122 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 74.330 - 1.700 |
| R-factor | 0.19287 |
| Rwork | 0.192 |
| R-free | 0.20777 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.140 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 113.561 | 1.726 |
| High resolution limit [Å] | 1.697 | 1.697 |
| Rmerge | 0.053 | 0.656 |
| Rpim | 0.018 | 0.343 |
| Number of reflections | 55734 | 2738 |
| <I/σ(I)> | 30 | |
| Completeness [%] | 100.0 | 99.3 |
| Redundancy | 16.5 | 7.5 |
| CC(1/2) | 1.000 | 0.795 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.5-1.0M lithium sulfate 0.5-1.0M ammonium sulfate 100mM tri-solium citrate pH 5.5 |
