7V6E
DREP3
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 5C (4A) |
Synchrotron site | PAL/PLS |
Beamline | 5C (4A) |
Temperature [K] | 125 |
Detector technology | PIXEL |
Collection date | 2018-03-28 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 1.0000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 56.460, 125.355, 168.447 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 42.110 - 3.000 |
R-factor | 0.2092 |
Rwork | 0.205 |
R-free | 0.25210 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4d2k |
RMSD bond length | 0.011 |
RMSD bond angle | 1.230 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.19.1_4122) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.110 | |
High resolution limit [Å] | 3.000 | 3.000 |
Rmerge | 0.140 | 0.053 |
Number of reflections | 45952 | 2406 |
<I/σ(I)> | 3.74 | |
Completeness [%] | 99.3 | |
Redundancy | 4.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293.15 | 0.1M citric acid pH 4.0, 0.8M ammonium sulfate |