5ZYD

Crystal Structure of Glucose Isomerase Soaked with Glucose

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	100
Detector technology	CCD
Collection date	2017-09-27
Detector	ADSC QUANTUM 270
Wavelength(s)	0.987
Spacegroup name	I 2 2 2
Unit cell lengths	92.505, 97.820, 102.297
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	70.700 - 1.400
R-factor	0.15148
Rwork	0.151
R-free	0.16529
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5y4i
RMSD bond length	0.022
RMSD bond angle	2.041
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]	70.700	1.420
High resolution limit [Å]	1.400	1.400
Rmerge	0.111	0.357
Rmeas	0.125	0.400
Rpim	0.570	0.178
Number of reflections	90913	4514
<I/σ(I)>	24.4	4.79
Completeness [%]	96.0	100
Redundancy	4.8	4.9
CC(1/2)		0.901

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293.5	PEG 400, MgCl2