8S8R

An induced-fit motion of a mobile loop

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-10-12
Detector	DECTRIS PILATUS 200K
Wavelength(s)	1
Spacegroup name	C 1 2 1
Unit cell lengths	79.321, 44.206, 63.460
Unit cell angles	90.00, 111.82, 90.00

Refinement procedure

Resolution	36.000 - 1.196
R-factor	0.196
Rwork	0.196
R-free	0.20840
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.784
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	36.810	35.070
High resolution limit [Å]	1.190	1.196
Rmerge	0.026
Number of reflections	62429	62429
<I/σ(I)>	37.69
Completeness [%]	96.6
Redundancy	6.5
CC(1/2)	0.990	0.990

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		277	ammonium phosphate