9JRS

Crystal structure of BH1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-04-01
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97954
Spacegroup name	I 2 3
Unit cell lengths	91.740, 91.740, 91.740
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.450 - 1.460
R-factor	0.2164
Rwork	0.213
R-free	0.25200
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond angle	17.352
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.21_5207: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.450	1.500
High resolution limit [Å]	1.460	1.460
Number of reflections	22379	1591
<I/σ(I)>	35.7
Completeness [%]	99.7
Redundancy	12
CC(1/2)	1.000	0.651

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	20 mM HEPES, Ph7.5, 150 mM NaCl, and 1 mM DTT