7WUK

Crystal structure of UBR bof from PRT6

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE BL13B1
Synchrotron site	NSRRC
Beamline	BL13B1
Temperature [K]	100
Detector technology	CCD
Collection date	2018-07-30
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.2831
Spacegroup name	P 32 2 1
Unit cell lengths	29.749, 29.749, 115.636
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	25.780 - 1.630
R-factor	0.1881
Rwork	0.186
R-free	0.21850
Structure solution method	SAD
RMSD bond length	0.013
RMSD bond angle	1.833
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.690
High resolution limit [Å]	1.630	3.510	1.630
Rmerge	0.041	0.021	0.130
Rmeas	0.044	0.023	0.143
Rpim	0.018	0.009	0.058
Total number of observations	88259
Number of reflections	14336	1452	1420
<I/σ(I)>	15.8
Completeness [%]	99.9	99.4	100
Redundancy	6.2	6.3	5.9
CC(1/2)		1.000	0.992

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	291	8% (v/v) Tacsimate, 20% PEG 3350