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 | 2024-04-05 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | .953 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 37.210, 58.080, 75.950 |
Unit cell angles | 90.00, 97.95, 90.00 |
Refinement procedure
Resolution | 35.070 - 1.200 |
R-factor | 0.1223 |
Rwork | 0.121 |
R-free | 0.14750 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.005 |
RMSD bond angle | 1.171 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.070 | 1.243 |
High resolution limit [Å] | 1.200 | 1.200 |
Rmerge | 0.044 | 0.199 |
Rmeas | 0.051 | 0.237 |
Rpim | 0.026 | 0.126 |
Number of reflections | 99659 | 9775 |
<I/σ(I)> | 15.35 | 4.98 |
Completeness [%] | 99.6 | 98.16 |
Redundancy | 3.7 | 3.2 |
CC(1/2) | 0.998 | 0.947 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291 | 25% PEG 3350, 0.1M Bis Tris, pH 5.5 |