6GJ5
CRYSTAL STRUCTURE OF KRAS G12D (GPPCP) IN COMPLEX WITH 15
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-F |
Synchrotron site | APS |
Beamline | 21-ID-F |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-07-24 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.98 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 42.074, 40.043, 94.284 |
Unit cell angles | 90.00, 101.14, 90.00 |
Refinement procedure
Resolution | 36.748 - 1.499 |
R-factor | 0.1852 |
Rwork | 0.184 |
R-free | 0.20280 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4epv |
RMSD bond length | 0.004 |
RMSD bond angle | 1.120 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX ((1.13rc1_2961: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 36.748 | 1.553 |
High resolution limit [Å] | 1.499 | 1.499 |
Rmerge | 0.075 | |
Number of reflections | 49619 | |
<I/σ(I)> | 2.7 | |
Completeness [%] | 99.6 | |
Redundancy | 4.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | 30% PEG3350, 0.2 M potassium acetate |