1DML

CRYSTAL STRUCTURE OF HERPES SIMPLEX UL42 BOUND TO THE C-TERMINUS OF HSV POL

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	SIEMENS
Temperature [K]	113
Detector technology	IMAGE PLATE
Collection date	1998-07-22
Detector	MARRESEARCH
Spacegroup name	P 1 21 1
Unit cell lengths	54.320, 100.070, 129.530
Unit cell angles	90.00, 100.62, 90.00

Refinement procedure

Resolution	12.000 - 2.700
R-factor	0.23
Rwork	0.230
R-free	0.28100
RMSD bond length	0.007
RMSD bond angle	25.000 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	SHARP
Refinement software	CNS (0.5)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.870	2.800
High resolution limit [Å]	2.700	2.700
Rmerge	0.077	0.244
Total number of observations	260475 *
Number of reflections	37576 *
<I/σ(I)>	18.4
Completeness [%]	99.0	99.8
Redundancy	7	3.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	7.5	295	PEGMME 5000, pH 7.5, vapor diffusion, temperature 22K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	7-10 (mg/ml)
2	1	reservoir	mPEG5000	10-14 (%)