6K1G

Crystal structure of the L-fucose isomerase soaked with Mn2+ from Raoultella sp.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 11C
Synchrotron site	PAL/PLS
Beamline	11C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-12-29
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.9796
Spacegroup name	P 21 21 21
Unit cell lengths	116.274, 163.278, 196.343
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 2.960
R-factor	0.19263
Rwork	0.189
R-free	0.25191
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1fui
RMSD bond length	0.010
RMSD bond angle	1.320
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0218)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	3.000
High resolution limit [Å]	2.950	2.950
Rmerge	0.120	0.463
Rmeas	0.134	0.539
Rpim	0.058	0.268
Number of reflections	73180	3296
<I/σ(I)>	17.343	2.293
Completeness [%]	93.8	85.9
Redundancy	4.4	3.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293.15	HEPES, PEG10000