6BM8

Crystal structure of glycoprotein B from Herpes Simplex Virus type I

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-07-29
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9792
Spacegroup name	H 3 2
Unit cell lengths	118.597, 118.597, 800.576
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	101.870 - 4.100
R-factor	0.2703
Rwork	0.269
R-free	0.28550
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2gum
RMSD bond length	0.006
RMSD bond angle	1.011
Data reduction software	XDS
Data scaling software	Aimless (0.5.23)
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	101.870	101.870	4.370
High resolution limit [Å]	3.990	9.770	3.990
Rmerge	0.109	0.026	1.221
Rmeas	0.131	0.032	1.460
Rpim	0.072	0.019	0.790
Total number of observations	62145
Number of reflections	19003	1392	4477
<I/σ(I)>	7
Completeness [%]	99.0	96.9	99.1
Redundancy	3.3	2.9	3.3
CC(1/2)	0.999	0.999	0.506

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295	11% PEG 4000, 0.1 M Tris HCl pH 7.5, 0.1 M NaCl