8XM1

Phytase mutant APPAmut4

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL10U2
Synchrotron site	SSRF
Beamline	BL10U2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-01-14
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	43.514, 46.016, 192.797
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	26.350 - 1.900
R-factor	0.1607
Rwork	0.158
R-free	0.20810
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.918
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	26.350	1.960
High resolution limit [Å]	1.900	1.900
Number of reflections	31168	2732
<I/σ(I)>	8.95	2.46
Completeness [%]	98.2
Redundancy	2
CC(1/2)	0.993	0.876

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.5	293	0.1 M Sodium acetate trihydrate pH 4.5; 30% w/v Polyethylene glycol 1,500