4LYB

CdS within a lysoyzme single crystal

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X12C
Synchrotron site	NSLS
Beamline	X12C
Temperature [K]	100
Detector technology	CCD
Detector	MAR CCD 165 mm
Wavelength(s)	1.0988
Spacegroup name	P 43 21 2
Unit cell lengths	78.677, 78.677, 37.251
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	10.000 - 1.210
Rwork	0.227
Structure solution method	AB INITIO
RMSD bond length	0.010
RMSD bond angle	0.025
Phasing software	SHELX
Refinement software	SHELXL-97

Data quality characteristics

	Overall
High resolution limit [Å]	1.210
Number of reflections	36271

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	4.5	298	6.5% NaCl (w/v) in 0.1 M sodium acetate, pH 4.5, EVAPORATION, temperature 298K , temperature 298.0K