8RNY

Hen Egg White Lysozyme soaked with with [H2Ind][trans-RuCl4(DMSO)(HInd)]

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	2019-01-24
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9184
Spacegroup name	P 43 21 2
Unit cell lengths	78.883, 78.883, 37.026
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.130 - 1.020
R-factor	0.1297
Rwork	0.129
R-free	0.14440
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.931
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.440	1.040
High resolution limit [Å]	1.020	1.020
Rmerge	0.013	0.217
Rmeas	0.018	0.306
Rpim	0.013	0.217
Number of reflections	57608	1909
<I/σ(I)>	18.7	1.3
Completeness [%]	95.0
Redundancy	1.9	1.9
CC(1/2)	1.000	0.673

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.5	293	0.8 NaCl, 0.05M sodium acetate