5MCU

New Insights into the Role of DNA Shape on Its Recognition by p53 Proteins (complex p53DBD-LHG2)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-04-28
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.976250
Spacegroup name	P 21 21 2
Unit cell lengths	109.133, 68.422, 69.422
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.900 - 1.700
R-factor	0.1704
Rwork	0.169
R-free	0.20100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDBID 1TSR
RMSD bond length	0.007
RMSD bond angle	0.867
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER (2.5.7)
Refinement software	PHENIX (dev-2276_1692)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.730
High resolution limit [Å]	1.700	4.610	1.700
Rmerge	0.109	0.071	0.397
Number of reflections	57404
<I/σ(I)>	5.5
Completeness [%]	99.3	98.8	99
Redundancy	5.3	7.4	3
CC(1/2)		0.997	0.945

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	7	292	0.05 M HEPES sodium salt, 12% w/v Polyethylene glycol 3,350