9JUI

Crystal structure of FFAT motif of Nir2 bound to VAPB

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	100
Detector technology	CCD
Collection date	2019-05-07
Detector	ADSC QUANTUM 270
Wavelength(s)	0.9795
Spacegroup name	P 32 2 1
Unit cell lengths	52.973, 52.973, 88.283
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	50.000 - 2.050
Rwork	0.276
R-free	0.28500
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.14)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.090
High resolution limit [Å]	2.050	5.560	2.050
Rmerge	0.113	0.066	0.516
Rmeas	0.132	0.079	0.594
Rpim	0.066	0.042	0.290
Total number of observations	36942
Number of reflections	9386	508	451
<I/σ(I)>	9.3
Completeness [%]	99.3	93	99.8
Redundancy	3.9	3	4.1
CC(1/2)	0.981	0.990	0.745

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277.15	18% PEG 8000, 0.1M sodium cacodylate pH 6.5, 0.2M zinc acetate dihydrate