6YVA

PLpro-C111S with mISG15

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-04-09
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.00001
Spacegroup name	P 62 2 2
Unit cell lengths	157.047, 157.047, 83.633
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	45.340 - 3.180
R-factor	0.2515
Rwork	0.250
R-free	0.29020
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6w9c 5tla
RMSD bond length	0.004
RMSD bond angle	0.634
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX (1.17.1_3660)
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.340	3.298
High resolution limit [Å]	3.180	3.185
Rmerge	0.058	0.569
Number of reflections	10590	1008
<I/σ(I)>	8.58	1.19
Completeness [%]	99.6	97.77
Redundancy	2	2
CC(1/2)	0.997	0.594

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	293	18% PEG4450, 100 mM bis-tris propane pH 6.5, 200 mM Potassium thiocyanate