6LVQ
Crystal structure of DUSP22_VO4
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE TPS 05A |
Synchrotron site | NSRRC |
Beamline | TPS 05A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-02-26 |
Detector | RAYONIX MX300-HS |
Wavelength(s) | 0.99987 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 36.130, 49.736, 39.847 |
Unit cell angles | 90.00, 108.13, 90.00 |
Refinement procedure
Resolution | 28.262 - 1.380 |
R-factor | 0.206 |
Rwork | 0.204 |
R-free | 0.22870 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1wrm |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER (2.8.3) |
Refinement software | PHENIX (1.16-3549) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.430 |
High resolution limit [Å] | 1.380 | 2.970 | 1.380 |
Rmerge | 0.107 | 0.044 | 0.578 |
Rmeas | 0.118 | 0.051 | 0.680 |
Rpim | 0.048 | 0.024 | 0.353 |
Total number of observations | 152760 | ||
Number of reflections | 27144 | 2763 | 2622 |
<I/σ(I)> | 9.8 | ||
Completeness [%] | 97.9 | 96.8 | 95.1 |
Redundancy | 5.6 | 4.7 | 3.3 |
CC(1/2) | 0.995 | 0.806 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.1 M MES, 2 mM MnCl2, 0.1 mM VO4, 25% PEG 4000 |