9C6M

Yasminevirus c12orf29, a 5' to 3' RNA ligase, K73M mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-12-02
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97891
Spacegroup name	P 1 21 1
Unit cell lengths	103.401, 86.048, 114.311
Unit cell angles	90.00, 105.19, 90.00

Refinement procedure

Resolution	43.700 - 2.600
R-factor	0.1964
Rwork	0.195
R-free	0.23520
Structure solution method	SAD
RMSD bond length	0.003
RMSD bond angle	0.601
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX (1.21.1_5286)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.560
High resolution limit [Å]	2.520	6.830	2.520
Rmerge	0.078	0.043	0.753
Rmeas	0.091	0.050	0.908
Rpim	0.045	0.025	0.499
Number of reflections	88037	3266	2186
<I/σ(I)>	7
Completeness [%]	94.2	97.4	68.4
Redundancy	3.6	3.7	2.7
CC(1/2)	0.985	0.987	0.573

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	293	1.85 M sodium malonate, 0.1 M Bis-Tris, 25% ethylene glycol