8OQW
Crystal structure of Tannerella forsythia MurNAc kinase MurK
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-07-18 |
Detector | DECTRIS EIGER2 XE 16M |
Wavelength(s) | 0.976 |
Spacegroup name | P 1 |
Unit cell lengths | 58.759, 59.510, 96.708 |
Unit cell angles | 74.30, 75.27, 65.95 |
Refinement procedure
Resolution | 49.503 - 2.050 |
Rwork | 0.201 |
R-free | 0.24860 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1x7f |
RMSD bond length | 0.004 |
RMSD bond angle | 1.126 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0352) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.503 | 2.170 |
High resolution limit [Å] | 2.050 | 2.050 |
Number of reflections | 68635 | 11045 |
<I/σ(I)> | 9.06 | |
Completeness [%] | 96.1 | |
Redundancy | 2.37 | |
CC(1/2) | 0.997 | 0.751 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2-0.3 M ammonium sulfate, 14-22% (w/v) PEG3350, bis-tris/citric acid pH 4.1-6.4 |