6J2R
Crystal structure of Striga hermonthica HTL8 (ShHTL8)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NFPSS BEAMLINE BL19U1 |
Synchrotron site | NFPSS |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2018-12-25 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.97890 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 43.628, 83.483, 84.077 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.161 - 1.400 |
R-factor | 0.1719 |
Rwork | 0.171 |
R-free | 0.18620 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6a9d |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX (1.16_3549) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 10.000 | 1.420 |
High resolution limit [Å] | 1.399 | 3.800 | 1.400 |
Rmerge | 0.080 | 0.061 | 0.308 |
Rmeas | 0.088 | 0.068 | 0.404 |
Rpim | 0.038 | 0.029 | 0.256 |
Number of reflections | 58744 | 3269 | 2039 |
<I/σ(I)> | 7.9 | ||
Completeness [%] | 95.4 | 97.9 | 67.3 |
Redundancy | 4.8 | 5.1 | 2 |
CC(1/2) | 0.993 | 0.826 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 303 | 0.2 M ammonium formate, 20% (w/v) PEG 3500 and 0.1 M ADA pH 6.6 |