7E6I

Glucose-6-phosphate dehydrogenase in complex with its substrate glucose-6-phosphate

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	2020-10-09
Detector	ADSC QUANTUM 270
Wavelength(s)	1.00
Spacegroup name	P 65 2 2
Unit cell lengths	120.254, 120.254, 214.980
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	34.970 - 2.390
R-factor	0.191
Rwork	0.189
R-free	0.22370
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2bh9
RMSD bond length	0.008
RMSD bond angle	0.971
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.18_3845)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.490
High resolution limit [Å]	2.390	2.390
Number of reflections	37034	3601
<I/σ(I)>	45.5
Completeness [%]	99.9
Redundancy	29.1
CC(1/2)	0.996	0.853

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.4 M sodium malonate dibasic pH 5.5 and 24% (w/v) PEG 3350, 20 mM G6P