5YDW

Full-length structure of HypT from Salmonella typhimuriuma (hypochlorite-specific LysR-type transcriptional regulator)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-11-04
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9999
Spacegroup name	C 2 2 21
Unit cell lengths	87.606, 114.556, 128.117
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.674 - 3.300
R-factor	0.2536
Rwork	0.251
R-free	0.29770
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5ydo
RMSD bond length	0.003
RMSD bond angle	0.546
Data reduction software	DENZO
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	3.360
High resolution limit [Å]	3.300	3.300
Rmerge	0.166	0.443
Rpim	0.061	0.244
Number of reflections	9592	460
<I/σ(I)>	8.3	2.33
Completeness [%]	95.0	95.8
Redundancy	6.7	3.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	287	0.1M sodium acetate, 0.1M MES (pH 6.5), 30%(v/v) PEG400, 2mM TCEP