7WDQ

DsyB in complex with SAM

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-12-05
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.987
Spacegroup name	P 21 21 21
Unit cell lengths	76.490, 115.931, 153.097
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	31.940 - 2.350
R-factor	0.1955
Rwork	0.192
R-free	0.25330
Structure solution method	SAD
RMSD bond length	0.008
RMSD bond angle	1.156
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.6.4_486)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.490
High resolution limit [Å]	2.350	5.171	2.400
Rmerge	0.086	0.046	0.495
Rmeas	0.093	0.050	0.535
Rpim	0.035	0.019	0.201
Number of reflections	56091	5892	5536
<I/σ(I)>	15.6
Completeness [%]	99.9	99.3	100
Redundancy	6.8	6.8	7
CC(1/2)		0.998	0.919

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.2 M NaCl, 0.1 M Hepes (pH 7.5) and 25% (wt/vol) polyethylene glycol (PEG) 3350