6QV1

Structure of ATPgS-bound outward-facing TM287/288 in complex with nanobody Nb_TM1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-09-02
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.000
Spacegroup name	P 1 21 1
Unit cell lengths	90.750, 199.260, 113.160
Unit cell angles	90.00, 91.26, 90.00

Refinement procedure

Resolution	34.640 - 3.480
R-factor	0.269
Rwork	0.267
R-free	0.30300
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.950
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	BUSTER (2.10.3)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	34.640	34.640	3.570
High resolution limit [Å]	3.480	15.580	3.480
Rmerge	0.054	0.022	0.797
Rmeas	0.058	0.024	0.854
Number of reflections	29868	576	108
<I/σ(I)>	16.31	71.84	3.26
Completeness [%]	58.2	96	2.9
Redundancy	7.109	6.738	7.741
CC(1/2)	1.000	1.000	0.739

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	9.5	293	0.05M Glycine, 0.225M NaCl, 21% (w/v) PEG 550MME