9PUL
HRAS complex with UM0143525 compound
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08B1-1 |
| Synchrotron site | CLSI |
| Beamline | 08B1-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-01-27 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 1.1806 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 127.780, 37.530, 143.120 |
| Unit cell angles | 90.00, 95.80, 90.00 |
Refinement procedure
| Resolution | 36.310 - 2.500 |
| R-factor | 0.2172 |
| Rwork | 0.214 |
| R-free | 0.26730 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.676 |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 36.310 | 2.550 |
| High resolution limit [Å] | 2.360 | 2.360 |
| Rmeas | 0.114 | 1.126 |
| Number of reflections | 23886 | 2308 |
| <I/σ(I)> | 6.9 | 2.53 |
| Completeness [%] | 99.5 | 99.48 |
| Redundancy | 6 | 1.3 |
| CC(1/2) | 0.997 | 0.877 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293.15 | 0.1M Tris, 0.2 M CaCl2, 18 % PEG 4,000 |
