6N86

Resistance to inhibitors of cholinesterase 8A (Ric8A) protein

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 4.2.2
Synchrotron site	ALS
Beamline	4.2.2
Temperature [K]	100
Detector technology	CMOS
Collection date	2018-02-15
Detector	RDI CMOS_8M
Wavelength(s)	1
Spacegroup name	F 2 2 2
Unit cell lengths	95.150, 134.340, 221.750
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	57.450 - 3.900
R-factor	0.2583
Rwork	0.257
R-free	0.29610
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.001
RMSD bond angle	0.392
Data reduction software	XDS
Data scaling software	SCALA (3.3.22)
Phasing software	PHASER
Refinement software	PHENIX ((1.14_3260: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	57.450	4.110
High resolution limit [Å]	3.900	3.900
Rmerge	0.097	0.799
Rmeas	0.107	0.867
Rpim	0.028	0.237
Number of reflections	6668	954
<I/σ(I)>	18.4	3.3
Completeness [%]	99.9	100
Redundancy	14.3	13.3
CC(1/2)	0.999	0.955

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	277	0.1 M Bis-Tris propane, 0.2 M NaI, 12-20 % PEG3350, seeding