8D6P

Rana catesbeiana saxiphilin mutant - Y558A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-02-26
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.033106
Spacegroup name	P 21 21 21
Unit cell lengths	96.605, 109.053, 254.888
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.810 - 2.600
R-factor	0.2297
Rwork	0.228
R-free	0.26370
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6o0f
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.810	2.650
High resolution limit [Å]	2.600	2.600
Rmerge	0.108
Number of reflections	83173	4517
<I/σ(I)>	12.9	0.9
Completeness [%]	99.6
Redundancy	13.4
CC(1/2)	0.998	0.532

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