3RS3
H-Ras soaked in neat hexane: 1 of 10 in MSCS set
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-12-17 |
Detector | MARRESEARCH |
Wavelength(s) | 1.0 |
Spacegroup name | H 3 2 |
Unit cell lengths | 88.328, 88.328, 135.128 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 19.827 - 1.520 |
R-factor | 0.1894 |
Rwork | 0.188 |
R-free | 0.20690 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.178 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX (1.7_650) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 20.000 | 20.000 | 1.570 |
High resolution limit [Å] | 1.520 | 3.270 | 1.520 |
Rmerge | 0.078 | 0.055 | 0.590 |
Number of reflections | 31339 | ||
<I/σ(I)> | 12.9 | ||
Completeness [%] | 99.7 | 99.5 | 97.7 |
Redundancy | 8.3 | 8.2 | 5.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | hanging drop | 7.5 | 298 | 20 % PEG 3350, 200mM Calcium Chloride, pH 7.5, hanging drop, temperature 298K |