8E3K

Human PU.1 ETS-Domain (165-270) Bound to d(AATAAGCGGAAGTGGG)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-02-02
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.000
Spacegroup name	P 1 21 1
Unit cell lengths	43.001, 60.742, 44.574
Unit cell angles	90.00, 116.71, 90.00

Refinement procedure

Resolution	33.300 - 1.280
R-factor	0.1282
Rwork	0.127
R-free	0.15120
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1pue
RMSD bond length	0.008
RMSD bond angle	1.099
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	33.300	1.326
High resolution limit [Å]	1.280	1.280
Rmerge	0.063	0.474
Rmeas	0.074	0.551
Rpim	0.038	0.276
Number of reflections	51827	5190
<I/σ(I)>	11.84	2.32
Completeness [%]	98.1	98.65
Redundancy	3.8	3.8
CC(1/2)	0.992	0.896

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.6	293	2% PEG 3350, 100 mM Sodium Acetate, pH 4.6