7XE6

T4 lysozyme mutant-S44C/C54T/N68C/A93C/C97A/T115C, pH7

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE AR-NW12A
Synchrotron site	Photon Factory
Beamline	AR-NW12A
Temperature [K]	100
Detector technology	CCD
Collection date	2006-01-25
Detector	ADSC QUANTUM 210
Wavelength(s)	1.0
Spacegroup name	P 32 2 1
Unit cell lengths	59.999, 59.999, 97.101
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	25.520 - 1.100
R-factor	0.1488
Rwork	0.148
R-free	0.16790
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5vnr
RMSD bond length	0.006
RMSD bond angle	1.001
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]	45.900	1.140
High resolution limit [Å]	1.100	1.100
Rmeas	0.066	0.609
Number of reflections	82294	8082
<I/σ(I)>	21	2.5
Completeness [%]	99.5
Redundancy	9.6
CC(1/2)	0.999	0.891

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		293	A crystal was soaked into precipitant-free solutions (pH7).