8UTL

Bovine trypsin in complex with Thr3Dap mutated microviridin J

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-07-06
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.9201
Spacegroup name	P 32 2 1
Unit cell lengths	71.476, 71.476, 73.297
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	28.510 - 1.560
R-factor	0.17328
Rwork	0.172
R-free	0.19431
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	REFMAC (8.0.013)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	28.510	1.616
High resolution limit [Å]	1.560	1.560
Rmerge	0.129	0.678
Rmeas	0.140	0.736
Number of reflections	31088	2984
<I/σ(I)>	9.87	2.39
Completeness [%]	99.4	96.91
Redundancy	6.6	6.3
CC(1/2)	0.992	0.862

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	295.37	0.2 M ammonium sulfate, 0.1 M sodium cacodylate pH 5.5, 15% PEG 8000