8WIM

Crystal structure of Jingmen tick virus RNA-dependent RNA polymerase (D307 construct)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2019-12-07
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9792
Spacegroup name	P 21 21 21
Unit cell lengths	61.522, 89.251, 122.405
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.110 - 1.840
R-factor	0.1818
Rwork	0.180
R-free	0.20920
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	in-house model determined by SAD
RMSD bond length	0.008
RMSD bond angle	0.918
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX (1.12)
Refinement software	PHENIX ((1.19.2_4158: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.910
High resolution limit [Å]	1.840	3.960	1.840
Rmerge	0.077	0.036	0.583
Rmeas	0.083	0.039	0.671
Rpim	0.031	0.014	0.320
Total number of observations	395284
Number of reflections	58904	6204	5474
<I/σ(I)>	9.6
Completeness [%]	99.1	98.9	93.5
Redundancy	6.7	7.1	3.6
CC(1/2)	0.999	0.999	0.772

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		289	potassium sodium tartrate tetrahyrate