5KXK

Hen Egg White Lysozyme at 100K, Data set 1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL14-1
Synchrotron site	SSRL
Beamline	BL14-1
Temperature [K]	100
Detector technology	CCD
Collection date	2013-07-19
Detector	MARMOSAIC 325 mm CCD
Wavelength(s)	1.21549
Spacegroup name	P 43 21 2
Unit cell lengths	77.289, 77.289, 37.205
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.645 - 1.198
R-factor	0.1514
Rwork	0.150
R-free	0.18050
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	1rqw
RMSD bond length	0.010
RMSD bond angle	1.356
Data reduction software	XDS
Data scaling software	SCALA (3.3.20)
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	37.203	37.203	1.260
High resolution limit [Å]	1.198	3.790	1.200
Rmerge		0.024	0.098
Number of reflections	35966
<I/σ(I)>	45.8	19.8	8
Completeness [%]	99.6	99.1	97.7
Redundancy	6.6	5.6	5.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.5	291	CRYSTALS WERE GROWN BY MIXING EQUAL VOLUMES OF WELL SOLUTION (1.0 M SODIUM CHLORIDE, 50 MM SODIUM ACETATE PH 4.5) AND PROTEIN (40-60 MG/ML)