8JJ6

Structure of the NELF-BCE complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	80
Detector technology	CCD
Collection date	2018-04-28
Detector	RAYONIX MX300-HS
Wavelength(s)	0.9789
Spacegroup name	P 21 21 2
Unit cell lengths	156.614, 166.709, 75.025
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.510 - 2.720
R-factor	0.2087
Rwork	0.206
R-free	0.26220
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	0.998
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.750
High resolution limit [Å]	2.700	2.700
Rmerge	0.287	1.647
Number of reflections	53240	2629
<I/σ(I)>	14.75
Completeness [%]	100.0
Redundancy	29.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1M BICINE pH 8.5 and 20% v/v Polyethylene glycol 300