4IAT

HEW Lysozyme by langmuir- blodgett modified vapour diffusion

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-4
Synchrotron site	ESRF
Beamline	ID14-4
Wavelength(s)	0.932
Spacegroup name	P 43 21 2
Unit cell lengths	78.780, 78.780, 36.990
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	55.706 - 2.000
R-factor	0.1788
Rwork	0.176
R-free	0.24160
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.022
RMSD bond angle	1.797
Data reduction software	MOSFLM
Data scaling software	SCALA (3.3.16)
Phasing software	MOLREP
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	55.706	39.390	2.110
High resolution limit [Å]	2.000	6.320	2.000
Rmerge		0.043	0.125
Total number of observations		3459	16214
Number of reflections	8328
<I/σ(I)>	31.8	13.1	5.3
Completeness [%]	100.0	99.6	100
Redundancy	13.3	10.8	13.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1