5O79
Klebsiella pneumoniae OmpK36
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I02 |
Synchrotron site | Diamond |
Beamline | I02 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-01-25 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.979 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 232.316, 74.511, 90.814 |
Unit cell angles | 90.00, 112.18, 90.00 |
Refinement procedure
Resolution | 107.570 - 1.650 |
R-factor | 0.14829 |
Rwork | 0.146 |
R-free | 0.18963 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1osm |
RMSD bond length | 0.014 |
RMSD bond angle | 1.588 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 107.570 | 1.680 |
High resolution limit [Å] | 1.650 | 1.650 |
Rpim | 0.039 | 0.607 |
Number of reflections | 169933 | 8276 |
<I/σ(I)> | 11.6 | 1.6 |
Completeness [%] | 98.5 | 97.3 |
Redundancy | 3.8 | 3.9 |
CC(1/2) | 0.689 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 295 | 0.08 M Magnesium Acetate tetrahydrate , 0.1 M sodium citrate, 14% w/v 5000 PEG MME |