7JQU

Abeta 16-36 beta-hairpin mimic with E22G Arctic mutation

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	123.15
Detector technology	CCD
Collection date	2017-02-15
Detector	RIGAKU SATURN 944+
Wavelength(s)	1.54
Spacegroup name	P 4 3 2
Unit cell lengths	67.341, 67.341, 67.341
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	23.809 - 2.611
R-factor	0.2475
Rwork	0.243
R-free	0.28110
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5w4h
RMSD bond length	0.004
RMSD bond angle	0.797
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.11.1_2575)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	23.810	2.705
High resolution limit [Å]	2.611	2.611
Rmerge	0.012	0.245
Number of reflections	3025	179
<I/σ(I)>	23.04
Completeness [%]	99.4
Redundancy	93.3
CC(1/2)	1.000	0.658

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		297.15	sodium citrate, isopropanol, PEG 4000