9EKN

Thomasclavelia ramosa Immunoglobulin A Protease Middle (Protease) Domain with C-terminal Domain #1 (Metal Chelated and Zinc Supplemented)

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 21 21 21
Unit cell lengths	71.132, 85.644, 92.124
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	62.730 - 1.780
R-factor	0.1725
Rwork	0.171
R-free	0.20720
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]	92.010	1.810
High resolution limit [Å]	1.780	1.780
Rmerge	0.102
Number of reflections	54207	2637
<I/σ(I)>	11	0.3
Completeness [%]	100.0
Redundancy	12.71
CC(1/2)	0.999	0.586

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