5Z7W

Crystal structure of Striga hermonthica HTL1 (ShHTL1)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-5A
Synchrotron site	Photon Factory
Beamline	BL-5A
Temperature [K]	95
Detector technology	PIXEL
Collection date	2017-02-13
Detector	DECTRIS PILATUS 2M
Wavelength(s)	1.0000
Spacegroup name	P 21 21 2
Unit cell lengths	81.170, 138.770, 49.410
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.953 - 1.657
R-factor	0.1708
Rwork	0.169
R-free	0.19930
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4jyp
RMSD bond length	0.004
RMSD bond angle	0.657
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.700
High resolution limit [Å]	1.657	1.657
Rmeas	0.071	0.875
Number of reflections	127266	8897
<I/σ(I)>	18	2.2
Completeness [%]	99.4	93.7
Redundancy	6.7	6.2
CC(1/2)	0.999	0.818

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	277	0.1M Tris-HCl (pH 8.5), 200mM MgCl2, 30% (w/v) PEG 4000