2DY0

Crystal structure of project JW0458 from Escherichia coli

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL26B1
Synchrotron site	SPring-8
Beamline	BL26B1
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2006-07-06
Detector	RIGAKU RAXIS V
Wavelength(s)	1.0
Spacegroup name	P 1
Unit cell lengths	40.106, 48.192, 54.795
Unit cell angles	109.40, 101.84, 110.56

Refinement procedure

Resolution	35.000 - 1.250
R-factor	0.198
Rwork	0.198
R-free	0.20700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB code 1ZN9
RMSD bond length	0.006
RMSD bond angle	1.400
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	CNS
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	1.290
High resolution limit [Å]	1.250	1.250
Rmerge	0.057	0.244
Number of reflections	88230
<I/σ(I)>	9.9	3.2
Completeness [%]	94.6	91.9
Redundancy	3.5	3.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Microbach	8.5	291	30 w/v(%) PEG 4000, 0.1M Tris, 0.2M Mg Chlor , pH 8.5, Microbach, temperature 291K