6GOF
KRAS full length G12D GPPNHP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-05-25 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.979 |
| Spacegroup name | H 3 |
| Unit cell lengths | 78.630, 78.630, 77.540 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 39.310 - 1.980 |
| R-factor | 0.18155 |
| Rwork | 0.178 |
| R-free | 0.25183 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4dst |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.496 |
| 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] | 39.310 | 2.030 |
| High resolution limit [Å] | 1.980 | 1.980 |
| Rmerge | 0.152 | 1.320 |
| Rmeas | 0.171 | 1.480 |
| Rpim | 0.054 | |
| Number of reflections | 12435 | |
| <I/σ(I)> | 11.2 | 1.7 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 10.1 | 9.9 |
| CC(1/2) | 0.560 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 0.1 M, TrisCl, 0.2 M NaOAc and 30-35 % PEG 4000 |
