5LED

Crystal structure of DARPin-DARPin rigid fusion, variant DDD_D12_12_D12_12_D12

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-05-06
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.00
Spacegroup name	P 1 21 1
Unit cell lengths	60.230, 47.550, 82.480
Unit cell angles	90.00, 92.04, 90.00

Refinement procedure

Resolution	47.806 - 2.600
R-factor	0.2571
Rwork	0.255
R-free	0.28980
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1SVX chain A
RMSD bond length	0.002
RMSD bond angle	0.430
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((dev_2400))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.806	2.693
High resolution limit [Å]	2.600	2.600
Rmerge	0.255	2.693
Number of reflections	14376
<I/σ(I)>	18.38
Completeness [%]	97.9
Redundancy	6.2
CC(1/2)	0.999

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	293	PEG 4000 20% w/v, Tris (HOAc) 0.1 M, Cadmium chloride 5 mM, pH 8.5