5VTE

Hetero antiparallel coiled coil hexamer formed by de novo peptides

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	2016-02-05
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0
Spacegroup name	H 3 2
Unit cell lengths	48.970, 48.970, 141.821
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	47.274 - 2.023
R-factor	0.2103
Rwork	0.207
R-free	0.23700
Structure solution method	SAD
RMSD bond length	0.003
RMSD bond angle	0.590
Data reduction software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX ((1.10_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.274	2.096
High resolution limit [Å]	2.023	2.023
Rmerge	0.045	0.091
Number of reflections	8400	342
<I/σ(I)>	10.63	3.76
Completeness [%]	93.0	89
Redundancy	5.4	4.3
CC(1/2)	0.993	0.977

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.75	298	0.1 M sodium formate, pH 6.75, PEG 3350 24%