8TBH
Tricomplex of RMC-7977, KRAS G12R, and CypA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-06-16 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 0.95375 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 66.418, 85.673, 127.534 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 63.770 - 1.500 |
R-factor | 0.1974 |
Rwork | 0.196 |
R-free | 0.22510 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 0.809 |
Data reduction software | HKL-2000 |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 63.770 | 1.554 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.105 | 2.692 |
Rmeas | 0.113 | 2.888 |
Rpim | 0.041 | 1.035 |
Number of reflections | 116906 | 11564 |
<I/σ(I)> | 7.51 | 0.55 |
Completeness [%] | 99.8 | 99.25 |
Redundancy | 7.3 | 7.5 |
CC(1/2) | 0.998 | 0.370 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291 | 17% PEG4000, 0.1 M imidazole, pH 8.0 |