4NBP

Crystal structure of the JCV large T-antigen origin binding domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X29A
Synchrotron site	NSLS
Beamline	X29A
Temperature [K]	100
Detector technology	CCD
Collection date	2013-04-13
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.075
Spacegroup name	P 41
Unit cell lengths	64.663, 64.663, 37.493
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.700 - 1.315
R-factor	0.1554
Rwork	0.154
R-free	0.17850
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.017
RMSD bond angle	1.610
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.8.4_1496))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	45.700	50.000	1.370
High resolution limit [Å]	1.315	2.840	1.320
Rmerge	0.093	0.074	0.658
Number of reflections	36181
<I/σ(I)>	29.6
Completeness [%]	97.8	100	99.4
Redundancy	16	20.2	12.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	0.19 M sodium tartrate, 19 % Peg 3350, VAPOR DIFFUSION, SITTING DROP, temperature 277K