7UOC

Crystal structure of Orobanche minor KAI2d4

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.1
Synchrotron site	ALS
Beamline	8.2.1
Temperature [K]	100
Detector technology	CCD
Collection date	2020-02-21
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.000
Spacegroup name	P 43 21 2
Unit cell lengths	97.448, 97.448, 147.668
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.720 - 2.300
R-factor	0.179
Rwork	0.176
R-free	0.23200
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4jyp
RMSD bond length	0.004
RMSD bond angle	0.645
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.20_4459)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.720	2.382
High resolution limit [Å]	2.300	2.300
Number of reflections	32317	65669
<I/σ(I)>	8.03
Completeness [%]	100.0	100
Redundancy	21.6	20.7
CC(1/2)	0.989	0.744

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	0.1 M sodium acetate pH 4.5, 0.8 M di-ammonium phosphate