4N6T

Adhiron: a stable and versatile peptide display scaffold - full length adhiron

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-01-24
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9686
Spacegroup name	P 41
Unit cell lengths	35.855, 35.855, 61.847
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.855 - 1.750
R-factor	0.1962
Rwork	0.195
R-free	0.22870
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.072
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.7.3_928))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	36.000	1.780
High resolution limit [Å]	1.750	1.750
Rmerge	0.082	0.897
Number of reflections	7889
<I/σ(I)>	18.9	2.6
Completeness [%]	99.3	91.6
Redundancy	12.8	7.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	280	Morpheus (H05), 0.02 M Glycine, 0.02 M Sodium L-Glutamate, 0.02 M DL-Alanine, 0.02 M DL-Lysine Hydrochloride, 0.02 M DL-Serine, 0.1 M MOPS pH=7.50, 0.1 M HEPES sodium salt pH=7.50, 10.0% w/v Polyethylene glycol 20000, 20.0% w/v Polyethylene glycol 550 MME, VAPOR DIFFUSION, SITTING DROP, temperature 280K