8PY1

Sensor domain of Asticcacaulis benevestitus chemoreceptor in complex with formate.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-02-15
Detector	DECTRIS PILATUS3 X 6M
Wavelength(s)	0.97918
Spacegroup name	I 41 2 2
Unit cell lengths	103.768, 103.768, 220.404
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	73.380 - 2.100
R-factor	0.2674
Rwork	0.266
R-free	0.30590
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.531
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	73.380	2.175
High resolution limit [Å]	2.100	2.100
Rmerge	0.116	1.179
Rmeas	0.122	1.311
Rpim	0.038	0.557
Number of reflections	35374	3397
<I/σ(I)>	4.3
Completeness [%]	99.0
Redundancy	8	5.4
CC(1/2)	0.997	0.701

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE	8.5	293	0.1 M Tris hydrochloride pH 8.5, 2.0 M Ammonium sulfate