4KI6

Ternary complex of rb69 mutant l415f with ribonucleotides at -1 and -2 position

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Detector technology	IMAGE PLATE
Collection date	2012-12-10
Detector	MAR scanner 300 mm plate
Wavelength(s)	1.5418
Spacegroup name	P 21 21 21
Unit cell lengths	80.853, 118.400, 127.970
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.947 - 2.550
R-factor	0.1972
Rwork	0.195
R-free	0.23260
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3cq8
RMSD bond length	0.002
RMSD bond angle	0.652
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX (1.8.1_1168)
Refinement software	PHENIX ((phenix.refine: 1.8.1_1168))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.590
High resolution limit [Å]	2.550	2.550
Number of reflections	39756
Completeness [%]	97.4	86.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	298	50 MM TRIS-HCL, 16% PEG350, 180 MM CALCIUM CHLORIDE, pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 298K