6FF9

Mutant R280K of human P53

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-05-17
Detector	DECTRIS PILATUS3 R CdTe 300K
Wavelength(s)	0.9677
Spacegroup name	P 1 21 1
Unit cell lengths	68.569, 69.445, 83.335
Unit cell angles	90.00, 90.04, 90.00

Refinement procedure

Resolution	41.670 - 2.000
R-factor	0.1841
Rwork	0.182
R-free	0.22600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2ocj
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	48.790	48.790	2.050
High resolution limit [Å]	2.000	8.940	2.000
Rmerge	0.118	0.040	0.833
Rmeas	0.137	0.046	0.961
Rpim	0.069	0.023	0.475
Number of reflections	50430	617	3749
<I/σ(I)>	8.6
Completeness [%]	95.3	97.7	96.6
Redundancy	3.9	3.6	4
CC(1/2)	0.994	0.997	0.815

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	35% PEG 3350