7LG9

ChsB1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	80
Detector technology	PIXEL
Collection date	2020-02-21
Detector	DECTRIS EIGER2 X 9M
Wavelength(s)	0.979
Spacegroup name	P 21 21 21
Unit cell lengths	44.854, 80.131, 163.532
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	81.770 - 2.030
R-factor	0.2159
Rwork	0.212
R-free	0.24980
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4kzp
RMSD bond length	0.003
RMSD bond angle	0.480
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	81.770	2.310
High resolution limit [Å]	2.030	2.030
Rmerge	0.200	1.130
Number of reflections	122908	122908
<I/σ(I)>	6.8
Completeness [%]	93.1
Redundancy	5.5
CC(1/2)	0.991	0.665

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		297.15	15% w/v PEG4000, 0.2M ammonium acetate, 0.1M sodium citrate pH5.6