9DVZ

Wild-Type E. coli Glucokinase with Glucose bound

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SEALED TUBE
Source details	RIGAKU PhotonJet-S
Temperature [K]	297
Detector technology	PIXEL
Collection date	2024-08-08
Detector	RIGAKU HyPix-6000HE
Wavelength(s)	1.54184
Spacegroup name	P 21 21 21
Unit cell lengths	47.535, 66.284, 207.527
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	22.720 - 2.540
R-factor	0.2061
Rwork	0.203
R-free	0.26010
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.541
Data reduction software	CrysalisPro
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	22.720	22.720	2.650
High resolution limit [Å]	2.540	8.780	2.540
Rmerge	0.218	0.069	0.592
Rmeas	0.243	0.083	0.657
Rpim	0.107	0.046	0.282
Number of reflections	22445	550	2708
<I/σ(I)>	5.5	7.7	2.6
Completeness [%]	99.7	89.3	100
Redundancy	5	2.8	5.3
CC(1/2)	0.983	0.995	0.802
Anomalous redundancy		1.6	2.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.46	297	100 mM Bis-Tris / Hydrochloric acid pH 6.5, 200 mM Magnesium chloride, and 23% (w/v) PEG 3350