7XE9

T4 lysozyme mutant-S44C/C54T/N68C/A93C/C97A/T115C, DMSO 20%

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]	100
Detector technology	CCD
Collection date	2007-11-06
Detector	ADSC QUANTUM 315
Wavelength(s)	1.0
Spacegroup name	P 32 2 1
Unit cell lengths	59.873, 59.873, 96.030
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	25.930 - 1.500
R-factor	0.2035
Rwork	0.202
R-free	0.23240
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5vnr
RMSD bond length	0.007
RMSD bond angle	1.216
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	25.930	1.550
High resolution limit [Å]	1.500	1.500
Rmeas	0.054	0.465
Number of reflections	32395	3067
<I/σ(I)>	30.7	3.8
Completeness [%]	99.5	95.8
Redundancy	10.3	7.7
CC(1/2)	0.999	0.949

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		293	A crystal was soaked into the precipitant-free solutions containing 20% DMSO.