2AP6

X-Ray Crystal Structure of Protein Atu4242 from Agrobacterium tumefaciens. Northeast Strucutral Genomics Consortium Target AtR43.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X4A
Synchrotron site	NSLS
Beamline	X4A
Temperature [K]	100
Detector technology	CCD
Collection date	2005-04-01
Detector	ADSC QUANTUM 4
Wavelength(s)	0.97908
Spacegroup name	P 21 21 2
Unit cell lengths	134.832, 134.830, 56.320
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.720 - 2.500
R-factor	0.1965
Rwork	0.197
R-free	0.28470
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1vqs
RMSD bond length	0.008
RMSD bond angle	1.400
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	COMO
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.590
High resolution limit [Å]	2.500	2.500
Rmerge	0.062	0.182
Number of reflections	61871
<I/σ(I)>	26.17	6.28
Completeness [%]	90.3	86.4
Redundancy	3.7	2.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1