7WVB

Human Fructose-1,6-bisphosphatase 1 mutant R50A in APO R-state

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	77.2
Detector technology	PIXEL
Collection date	2022-01-03
Detector	DECTRIS PILATUS3 X 6M
Wavelength(s)	0.9785
Spacegroup name	P 21 2 21
Unit cell lengths	102.182, 175.131, 81.607
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	33.440 - 2.090
R-factor	0.1957
Rwork	0.195
R-free	0.23310
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7cvh
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX (1.20_4459)
Refinement software	PHENIX (1.20_4459)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.140
High resolution limit [Å]	2.090	5.700	2.100
Rmerge	0.173	0.070	0.955
Rmeas	0.181	0.073	1.005
Rpim	0.051	0.021	0.306
Number of reflections	86259	4650	4159
<I/σ(I)>	4
Completeness [%]	99.3	99.9	97.1
Redundancy	12.3	11.8	10.2
CC(1/2)		0.998	0.791

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	293.15	0.1M BIS-Tris(pH 6.5), 20% PEGMME 5000, 2.5% sucrose