9YAV

Rana catesbeiana saxiphilin mutant - F561A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.3.1
Synchrotron site	ALS
Beamline	8.3.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-05-16
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.11590
Spacegroup name	P 21 21 21
Unit cell lengths	96.345, 110.241, 254.696
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.170 - 2.230
R-factor	0.212
Rwork	0.210
R-free	0.24380
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.671
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.170	2.260
High resolution limit [Å]	2.230	2.230
Number of reflections	132748	6507
<I/σ(I)>	19.6
Completeness [%]	100.0
Redundancy	13.1
CC(1/2)	1.000	0.674

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	277.15	0.08-0.2 M sodium cacodylate, pH 6.5, 5% PEG8000, 33% MPD