7OEY
Neisseria gonnorhoeae variant E93Q at 1.35 angstrom resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2) |
Synchrotron site | PETRA III, EMBL c/o DESY |
Beamline | P14 (MX2) |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-09-04 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.68880 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 172.400, 55.040, 84.370 |
Unit cell angles | 90.00, 108.69, 90.00 |
Refinement procedure
Resolution | 45.880 - 1.350 |
R-factor | 0.1371 |
Rwork | 0.136 |
R-free | 0.16200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6zx4 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHENIX |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 45.880 | 45.880 | 1.390 |
High resolution limit [Å] | 1.350 | 6.040 | 1.350 |
Rmerge | 0.056 | 0.034 | 0.795 |
Rmeas | 0.064 | 0.039 | 0.896 |
Total number of observations | 732213 | ||
Number of reflections | 160849 | 1666 | 11909 |
<I/σ(I)> | 11.85 | 28.06 | 2 |
Completeness [%] | 97.8 | 85.7 | 98.1 |
Redundancy | 4.552 | 4.38 | 4.683 |
CC(1/2) | 0.998 | 0.996 | 0.851 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293.15 | PEG8000, Sodium citrate, sodium phosphate |