4NB3

Crystal structure of RPA70N in complex with a 3,4 dichlorophenylalanine ATRIP derived peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-D
Synchrotron site	APS
Beamline	21-ID-D
Temperature [K]	100
Detector technology	IMAGE PLATE
Detector	MAR scanner 300 mm plate
Wavelength(s)	0.97872
Spacegroup name	C 1 2 1
Unit cell lengths	90.145, 46.803, 78.792
Unit cell angles	90.00, 120.64, 90.00

Refinement procedure

Resolution	26.170 - 1.350
R-factor	0.1457
Rwork	0.144
R-free	0.17470
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4pic
RMSD bond length	0.018
RMSD bond angle	1.935
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX (1.8.2_1309)
Refinement software	PHENIX ((phenix.refine: 1.8.2_1309))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	26.170	1.400
High resolution limit [Å]	1.350	1.350
Number of reflections	60645
<I/σ(I)>	11.57
Completeness [%]	97.6	91.2
Redundancy	7.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	295	100 mM Bis-Tris, 200 mM ammonium acetate, 25% PEG 3350, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K