37ZA

Crystal structure of TP53 (89-293, Y220C)

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-09-09
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97853
Spacegroup name	P 1 21 1
Unit cell lengths	50.310, 68.440, 60.120
Unit cell angles	90.00, 98.81, 90.00

Refinement procedure

Resolution	44.870 - 2.110
Rwork	0.202
R-free	0.26330
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.200
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.870	2.170
High resolution limit [Å]	2.110	2.110
Rmerge	0.113	0.830
Rmeas	0.134	0.988
Rpim	0.071	0.526
Number of reflections	23331	1913
<I/σ(I)>	11
Completeness [%]	99.9
Redundancy	6.7
CC(1/2)	0.997

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.05 M ammonium sulfate, 15 %w/v PEG 8000, 0.1 M sodium citrate