8QWP

Structure of p53 cancer mutant Y236C

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-04-25
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	65.154, 71.055, 105.258
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.700 - 2.100
R-factor	0.225057927431
Rwork	0.223
R-free	0.26839
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.007
RMSD bond angle	0.850
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.700	2.160
High resolution limit [Å]	2.100	2.100
Rmerge	0.181	0.949
Number of reflections	28446	2331
<I/σ(I)>	6.7	2
Completeness [%]	97.8	99.3
Redundancy	5.4	5.5
CC(1/2)	0.994	0.764

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	Protein solution: 5.5-6.0 mg/ml in 25 mM HEPES (pH 7.5), 200 mM NaCl, 0.5 mM TCEP. Reservoir buffer: 19% PEG 3350 (w/v), 5% ethylene glycol (v/v), 0.2 M Na/K tartrate.