7OYJ

Crystal structure of hTEAD2 in complex with fragment at the interface 2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE MASSIF-1
Synchrotron site	ESRF
Beamline	MASSIF-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-04-18
Detector	DECTRIS PILATUS3 2M
Wavelength(s)	0.965459
Spacegroup name	C 1 2 1
Unit cell lengths	113.507, 61.294, 80.224
Unit cell angles	90.00, 111.22, 90.00

Refinement procedure

Resolution	53.040 - 1.910
R-factor	0.1968
Rwork	0.196
R-free	0.22170
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5dq8
Data reduction software	xia2
Data scaling software	xia2
Refinement software	PHENIX (1.19.1-4122)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	74.786	74.786	1.794
High resolution limit [Å]	1.592	5.091	1.592
Rmerge	0.033	0.025	0.537
Rmeas	0.042	0.032	0.665
Rpim	0.025	0.020	0.386
Total number of observations		5033	5339
Number of reflections	65881	2128	2129
<I/σ(I)>	14.8	40.8	1.6
Completeness [%]	91.8	97.1	65.4
Redundancy	2.4	2.4	2.5
CC(1/2)	0.998	0.995	0.713

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	2.8M sodium formate