6TRK

Phl p 6 fold stabilized mutant - S46Y

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-11-21
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9763
Spacegroup name	P 2 21 21
Unit cell lengths	47.825, 73.515, 76.124
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	33.800 - 1.600
R-factor	0.1571
Rwork	0.156
R-free	0.18770
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1nlx
RMSD bond length	0.009
RMSD bond angle	0.993
Data reduction software	SCALA
Refinement software	PHENIX (1.17_3644)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.940	1.690
High resolution limit [Å]	1.600	1.600
Number of reflections	34555	5013
<I/σ(I)>	9.3	2.3
Completeness [%]	96.9	97.5
Redundancy	3.5	3.1
CC(1/2)	0.998	0.778

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	50 mM Zinc acetate dehydrate, 10% (w/v) PEG 3350