5J0L

De novo design of protein homo-oligomers with modular hydrogen bond network-mediated specificity

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.2
Synchrotron site	ALS
Beamline	8.2.2
Temperature [K]	100
Detector technology	CCD
Collection date	2015-01-28
Detector	ADSC QUANTUM 315r
Wavelength(s)	1
Spacegroup name	P 65
Unit cell lengths	152.650, 152.650, 70.190
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	66.099 - 2.630
R-factor	0.2362
Rwork	0.232
R-free	0.28830
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.736
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX (1.7.2_869)

Data quality characteristics

	Overall
Low resolution limit [Å]	66.100
High resolution limit [Å]	2.630
Number of reflections	27911
<I/σ(I)>	17.9
Completeness [%]	100.0
Redundancy	12.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M Sodium Acetate trihydrate pH 4.5, 3.0 M Sodium chloride