5WJG

Using sound pulses to solve the crystal harvesting bottleneck

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-06-16
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.97913
Spacegroup name	P 43 21 2
Unit cell lengths	68.041, 68.041, 102.286
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	102.290 - 1.500
R-factor	0.12528
Rwork	0.124
R-free	0.15736
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4fon
RMSD bond length	0.025
RMSD bond angle	2.208
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0073)

Data quality characteristics

	Overall
Low resolution limit [Å]	102.290
High resolution limit [Å]	1.500
Rmerge	0.076
Number of reflections	36472
<I/σ(I)>	21.8
Completeness [%]	97.9
Redundancy	10.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE	6.5	295	0.1 M BisTris pH 6.5, 0.08M CaCl2