8TBN
Tricomplex of RMC-7977, KRAS G12S, and CypA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS-II BEAMLINE 17-ID-2 |
Synchrotron site | NSLS-II |
Beamline | 17-ID-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-12-17 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.97934 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 65.776, 84.343, 126.632 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.500 - 1.460 |
R-factor | 0.1552 |
Rwork | 0.153 |
R-free | 0.19660 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.016 |
RMSD bond angle | 1.425 |
Data reduction software | HKL-2000 |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.500 | 1.512 |
High resolution limit [Å] | 1.460 | 1.460 |
Rmerge | 0.086 | 2.045 |
Rmeas | 0.092 | 2.197 |
Rpim | 0.034 | 0.793 |
Number of reflections | 120857 | 11653 |
<I/σ(I)> | 9.99 | 0.99 |
Completeness [%] | 98.4 | 96.14 |
Redundancy | 7.3 | 7.3 |
CC(1/2) | 0.998 | 0.375 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 291 | 22% PEG6000, 0.1 M imidazole, pH 7 |