3GPL

Crystal structure of the ternary complex of RecD2 with DNA and ADPNP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2008-06-20
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.5418
Spacegroup name	P 1 21 1
Unit cell lengths	66.120, 130.360, 80.050
Unit cell angles	90.00, 107.34, 90.00

Refinement procedure

Resolution	43.270 - 2.500
R-factor	0.232
Rwork	0.232
R-free	0.27300
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3e1s
RMSD bond length	0.006
RMSD bond angle	1.400
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	CNS (1.2)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.600
High resolution limit [Å]	2.500	2.500
Rmerge	0.047	0.251
Number of reflections	44090
<I/σ(I)>	16.05	3.83
Completeness [%]	98.4	94.6
Redundancy	2.3	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	298	10% PEG 8000, 100 mM Tris-HCl pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

Crystallization Reagents

ID	crystal ID	solution ID	reagent name	concentration	details
1	1	1	PEG 8000
2	1	1	Tris-HCl
3	1	2	PEG 8000
4	1	2	Tris-HCl