6MOG

Dimeric DARPin C_R3

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-07-23
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97946
Spacegroup name	P 1 21 1
Unit cell lengths	36.250, 89.810, 44.270
Unit cell angles	90.00, 99.13, 90.00

Refinement procedure

Resolution	33.248 - 1.210
R-factor	0.1418
Rwork	0.141
R-free	0.17100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	predicted model
RMSD bond length	0.009
RMSD bond angle	1.032
Data reduction software	XDS (Jun 1, 2017)
Data scaling software	XSCALE (Jun 1, 2017)
Phasing software	PHASER
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	33.250	1.253
High resolution limit [Å]	1.210	1.210
Rmerge	0.051	1.564
Rpim	0.021	0.643
Number of reflections	83274	8248
<I/σ(I)>	14.8	1.34
Completeness [%]	88.2	72
Redundancy	6.8	6.7
CC(1/2)	0.999	0.669

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	295	0.1 M Tris pH 8.5, 25% PEG 3350, 1 mM reduced glutathione, 1 mM oxidized glutathione, 25% ethylene glycol cryoprotectant