4JLU

Crystal structure of BRCA1 BRCT with doubly phosphorylated Abraxas

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	BRUKER AXS MICROSTAR
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2013-02-22
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.54179
Spacegroup name	P 61 2 2
Unit cell lengths	113.599, 113.599, 121.610
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	22.190 - 3.500
R-factor	0.2997
Rwork	0.298
R-free	0.32730
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1y98
RMSD bond length	0.016
RMSD bond angle	1.960
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	REFMAC (5.5.0110)

Data quality characteristics

	Overall
Low resolution limit [Å]	25.000
High resolution limit [Å]	3.500
Number of reflections	6221

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5		pH 6.5, VAPOR DIFFUSION, HANGING DROP