6VRN

T cell receptor-p53-HLA-A2 complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-BM
Synchrotron site	APS
Beamline	19-BM
Temperature [K]	100
Detector technology	CCD
Collection date	2019-10-23
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	44.242, 87.439, 245.867
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	20.000 - 2.460
R-factor	0.1975
Rwork	0.194
R-free	0.25940
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5d2l 5yxn 3qeq
RMSD bond length	0.010
RMSD bond angle	1.631
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.000	2.550
High resolution limit [Å]	2.460	2.460
Rmerge	0.144	0.603
Number of reflections	34785	3229
<I/σ(I)>	7.9
Completeness [%]	96.9
Redundancy	5.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	6.7	295	20% (w/v) PEG 3350, 0.2 M ammonium tartrate dibasic