1R6K

HPV11 E2 TAD crystal structure

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X4A
Synchrotron site	NSLS
Beamline	X4A
Temperature [K]	100
Detector technology	CCD
Collection date	2000-03-01
Detector	ADSC QUANTUM 4
Wavelength(s)	0.9790,0.9794,0.9743,0.9879
Spacegroup name	C 2 2 2
Unit cell lengths	54.860, 169.900, 46.110
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	50.000 - 2.500
R-factor	0.2566
Rwork	0.257
R-free	0.30300 *
Structure solution method	MAD
RMSD bond length	0.009 *
RMSD bond angle	1.329
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.590
High resolution limit [Å]	2.500	2.500
Rmerge	0.087	0.342
Total number of observations	68569 *
Number of reflections	7724 *
<I/σ(I)>	28.75	5.36
Completeness [%]	97.1	99
Redundancy	8.88

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5	4 *	Na Succinate, PEG 5000, mme, Ammonium Sulfate, pH 5.0, VAPOR DIFFUSION, HANGING DROP, temperature 277K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	reservoir	sodium succinate	0.1 (M)	pH5.0
2	1	reservoir	PEG5000 MME	18 (%)
3	1	reservoir	ammonium sulfate	0.2 (M)