6K8G

H/D exchanged Hen egg-white lysozyme

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	293
Detector technology	IMAGE PLATE
Collection date	2018-02-13
Detector	RIGAKU
Wavelength(s)	1.54
Spacegroup name	P 43 21 2
Unit cell lengths	79.094, 79.094, 37.828
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.120 - 2.000
Rwork	0.225
R-free	0.25540
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	193l
RMSD bond length	0.013
RMSD bond angle	1.320
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX (1.17_3644)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	100.000	2.070
High resolution limit [Å]	2.000	2.000
Rmerge	0.058	0.115
Rmeas	0.059	0.118
Rpim	0.011	0.024
Number of reflections	8051	550
<I/σ(I)>	63.5	26.2
Completeness [%]	93.3	65.7
Redundancy	25.2	22

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.6	293	NaCl, sodium acetate-d3, acetic acid-d4, 100% D2O
1	VAPOR DIFFUSION, SITTING DROP	4.6	293	NaCl, sodium acetate-d3, acetic acid-d4, 100% D2O