5Z0Q

Crystal Structure of OvoB

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	2017-11-25
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97853
Spacegroup name	P 1
Unit cell lengths	58.123, 133.590, 165.703
Unit cell angles	89.39, 84.58, 86.56

Refinement procedure

Resolution	42.973 - 2.770
R-factor	0.2125
Rwork	0.210
R-free	0.26690
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4dgt
RMSD bond length	0.002
RMSD bond angle	0.513
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX
Refinement software	PHENIX ((1.12_2829))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.820
High resolution limit [Å]	2.770	2.770
Number of reflections	125870
<I/σ(I)>	7.05
Completeness [%]	96.7
Redundancy	3.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		289	PEG 8000, sodium cacodylate, calcium acetate, glycerol