5ZN9

Crystal structure of PX domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NFPSS BEAMLINE BL18U
Synchrotron site	NFPSS
Beamline	BL18U
Temperature [K]	293
Detector technology	PIXEL
Collection date	2017-03-25
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9796
Spacegroup name	P 21 21 21
Unit cell lengths	98.334, 47.707, 47.832
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.167 - 1.776
R-factor	0.1916
Rwork	0.189
R-free	0.21730
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3lui
RMSD bond length	0.006
RMSD bond angle	0.824
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.170	1.840
High resolution limit [Å]	1.776	1.776
Number of reflections	21984
<I/σ(I)>	22.1
Completeness [%]	98.2
Redundancy	12.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291.15	0.1M LiSO4; 0.1M Tris; pH 8.5; 25% PEG3350