5HTK

Human Heart 6-Phosphofructo-2-Kinase/Fructose-2,6-Bisphosphatase (PFKFB2)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CAMD BEAMLINE GCPCC
Synchrotron site	CAMD
Beamline	GCPCC
Temperature [K]	80
Detector technology	CCD
Collection date	2015-02-02
Detector	MAR CCD 165 mm
Wavelength(s)	1.3808
Spacegroup name	P 21 21 21
Unit cell lengths	106.523, 113.946, 133.154
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.550 - 2.010
R-factor	0.1506
Rwork	0.149
R-free	0.17490
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1k6m
RMSD bond length	0.016
RMSD bond angle	1.400
Data reduction software	DENZO
Data scaling software	HKL-2000
Refinement software	PHENIX ((dev_2000:))

Data quality characteristics

	Overall
Low resolution limit [Å]	38.550
High resolution limit [Å]	2.010
Number of reflections	106633
<I/σ(I)>	16.2
Completeness [%]	98.0
Redundancy	4.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	285	100mM MES, 0.5-3.0% polyethylene glycol 8000, 13-16% polyethylene glycol 3350, and 3% dioxane