9XEY

Room temperature structure of glucose isomerase by serial femtosecond crystallography

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	FREE ELECTRON LASER
Source details	PAL-XFEL BEAMLINE NCI
Synchrotron site	PAL-XFEL
Beamline	NCI
Temperature [K]	298
Detector technology	CCD
Collection date	2025-08-20
Detector	RAYONIX MX225-HS
Wavelength(s)	1.3045
Spacegroup name	I 2 2 2
Unit cell lengths	93.730, 99.530, 102.490
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	71.400 - 1.650
R-factor	0.1964
Rwork	0.196
R-free	0.22910
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.822
Data reduction software	CrystFEL
Data scaling software	CrystFEL
Phasing software	PHASER
Refinement software	PHENIX ((1.17.1_3660: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	71.940	1.710
High resolution limit [Å]	1.650	1.650
Number of reflections	58242	5759
<I/σ(I)>	4.07
Completeness [%]	100.0
Redundancy	436.9
CC(1/2)	0.907	0.511

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE		273	Tris, MgCl