7BR5

Lysozyme-sugar complex in H2O

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-5A
Synchrotron site	Photon Factory
Beamline	BL-5A
Temperature [K]	100
Detector technology	CCD
Collection date	2015-11-22
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0
Spacegroup name	P 43 21 2
Unit cell lengths	77.309, 77.309, 38.214
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	16.833 - 1.000
R-factor	0.1401
Rwork	0.139
R-free	0.16690
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4wld
RMSD bond length	0.007
RMSD bond angle	1.100
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	16.833	1.020
High resolution limit [Å]	1.000	1.000
Rmerge	0.076	0.894
Number of reflections	61904	3096
<I/σ(I)>	72.2	3.5
Completeness [%]	98.5
Redundancy	14.6
CC(1/2)		0.860

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH	4.5	293	40mg/mL lysozyme containing 2.1mg/mL (GlcNAc)4, 0.7M NaCl in a buffer of 50mM sodium-acetate (pH4.5)