5LE2

Crystal structure of DARPin-DARPin rigid fusion, variant DDD_D12_15_D12_15_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	92.970, 53.790, 144.000
Unit cell angles	90.00, 107.11, 90.00

Refinement procedure

Resolution	47.999 - 2.400
R-factor	0.2493
Rwork	0.248
R-free	0.28090
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1SVX chain A
RMSD bond length	0.003
RMSD bond angle	0.465
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((dev_2386))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.999	2.486
High resolution limit [Å]	2.400	2.400
Rmerge	0.199	12.400
Number of reflections	53205
<I/σ(I)>	6.13
Completeness [%]	97.8
Redundancy	6.6
CC(1/2)	0.997

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	PEG 8000 10.0%, PEG 1000 10.0%, KSCN 0.2 M, Tris (HOAc) 0.1 M, pH 7.5