6TJ8
Escherichia coli transketolase in complex with cofactor analog 2'-methoxythiamine diphosphate
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 | 2016-06-02 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 1 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 89.550, 101.910, 132.960 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.285 - 0.921 |
R-factor | 0.0952 |
Rwork | 0.095 |
R-free | 0.10640 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1qgd |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHENIX |
Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.300 | 0.950 |
High resolution limit [Å] | 0.920 | 0.920 |
Rmeas | 0.095 | 0.061 |
Number of reflections | 780617 | 46733 |
<I/σ(I)> | 9.73 | |
Completeness [%] | 93.8 | 61.6 |
Redundancy | 4.2 | 2.9 |
CC(1/2) | 0.994 | 0.670 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.9 | 279.15 | PEG6000, Glycerol, Glycyl-Glycine |