6JR9

ZHD/W183F complex with ZEN

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-04-19
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97916
Spacegroup name	P 21 21 21
Unit cell lengths	74.660, 90.170, 113.520
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.000 - 1.720
R-factor	0.14252
Rwork	0.141
R-free	0.16363
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5c8z
RMSD bond length	0.014
RMSD bond angle	1.797
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0238)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	113.520	1.760
High resolution limit [Å]	1.720	1.720
Rmerge	0.210	0.632
Rpim	0.100	0.300
Number of reflections	82387	6011
<I/σ(I)>	19
Completeness [%]	100.0
Redundancy	10.7
CC(1/2)	0.995	0.947

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	ammonium phosphate, imidazole, potassium chloride