6LHD

Crystal structure of p53/BCL-xL fusion complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	CCD
Collection date	2018-11-17
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97
Spacegroup name	P 1 21 1
Unit cell lengths	72.221, 68.850, 75.028
Unit cell angles	90.00, 110.27, 90.00

Refinement procedure

Resolution	49.217 - 2.499
R-factor	0.2048
Rwork	0.202
R-free	0.26010
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3kmd 2yxj
RMSD bond length	0.004
RMSD bond angle	0.592
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.11.1_2575)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.599
High resolution limit [Å]	2.499	2.499
Rmerge	0.116	0.633
Rmeas	0.139	0.755
Number of reflections	23478	2185
<I/σ(I)>	7.89	2.46
Completeness [%]	97.0
Redundancy	3.4
CC(1/2)	0.899	0.766

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	291.15	0.2M sodium malonate pH 7.0, 20%(w/v) polyethylene glycol 3,350