6TGS

AtNBR1-PB1 domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-2
Synchrotron site	ESRF
Beamline	ID23-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-12-08
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.873
Spacegroup name	P 21 21 2
Unit cell lengths	43.128, 79.438, 24.135
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.900 - 1.530
R-factor	0.2221
Rwork	0.220
R-free	0.25490
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	EMD-10499
RMSD bond length	0.007
RMSD bond angle	0.900
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((dev_3500: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.900	1.585
High resolution limit [Å]	1.530	1.530
Rmerge	0.028	0.413
Rmeas		0.584
Rpim	0.028	0.413
Number of reflections	12367	1271
<I/σ(I)>	10.45	1.42
Completeness [%]	99.2
Redundancy	2
CC(1/2)	0.999	0.655

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1 M MES (pH 6.5), 18-20% (w/v) PEG20000