7V34

The complex structure of soBcmB and its product 1d

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	2020-06-22
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.03315
Spacegroup name	P 61 2 2
Unit cell lengths	100.990, 100.990, 131.387
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	47.134 - 2.000
R-factor	0.175625226054
Rwork	0.174
R-free	0.21014
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7v3o
RMSD bond length	0.007
RMSD bond angle	0.877
Data reduction software	XDS
Data scaling software	pointless
Phasing software	PHASER
Refinement software	PHENIX (1.11.1_2575)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.134	2.050
High resolution limit [Å]	2.000	2.000
Rmerge	0.124	1.022
Number of reflections	27428	1987
<I/σ(I)>	23.3
Completeness [%]	100.0
Redundancy	26.8
CC(1/2)	0.999	0.930

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1M Tris pH 8.0, 1.6M Ammonium sulfate