9RZL

Hen egg-white lysozyme (HEWL)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.1
Synchrotron site	BESSY
Beamline	14.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-11-12
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9184
Spacegroup name	P 43 21 2
Unit cell lengths	77.526, 77.526, 37.438
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.670 - 0.900
R-factor	0.1195
Rwork	0.119
R-free	0.13020
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.012
RMSD bond angle	1.203
Data reduction software	XDS (20161101)
Data scaling software	XDS (20161101)
Phasing software	PHENIX (1.20.1_4487)
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.800	0.950
High resolution limit [Å]	0.900	0.900
Rmerge	0.048	0.666
Rmeas	0.049	0.711
Number of reflections	82953	11658
<I/σ(I)>	31	2.23
Completeness [%]	97.7	86
Redundancy	21.5	8
CC(1/2)	1.000	0.576

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.5	295	100 mM NaAc/HCl pH 4.5, 0.80 M NaCl