9EKK

Thomasclavelia ramosa Immunoglobulin A Protease Middle (Protease) Domain with C-terminal Domain #1 (Crystallized as Purified)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08B1-1
Synchrotron site	CLSI
Beamline	08B1-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-03-21
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.1808
Spacegroup name	P 1 21 1
Unit cell lengths	70.689, 91.270, 86.860
Unit cell angles	90.00, 91.09, 90.00

Refinement procedure

Resolution	55.340 - 1.650
R-factor	0.1977
Rwork	0.196
R-free	0.23070
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	91.450	1.670
High resolution limit [Å]	1.650	1.650
Rmerge	0.083	1.410
Number of reflections	122442	21824
<I/σ(I)>	14.4	0.6
Completeness [%]	92.4
Redundancy	6.57
CC(1/2)	0.997	0.591

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	298	0.1M Bis-Tris, pH 6.5 + 25% (w/v) PEG 3350 + 10 mM praseodymium (III) acetate