9CIY

Right-left hybrid parallel G-quadruplex from NSD1 promoter

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	196
Detector technology	PIXEL
Collection date	2023-07-09
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.920105
Spacegroup name	P 42 2 2
Unit cell lengths	71.849, 71.849, 41.637
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.200 - 2.400
R-factor	0.1984
Rwork	0.197
R-free	0.23210
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.762
Data reduction software	autoPROC
Data scaling software	autoPROC
Phasing software	PHENIX (1.19.2_4158)
Refinement software	PHENIX ((1.21.1_5286: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.640	2.490
High resolution limit [Å]	2.390	2.390
Rmerge	0.120	2.266
Number of reflections	4625	828
<I/σ(I)>	12.9
Completeness [%]	99.8	98.9
Redundancy	15.1	14.1
CC(1/2)	0.997	0.563

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	285	0.2 M potassium chloride 5 mM Hexammine cobalt chloride 0.05 M MES pH 6.5 25% PEG 4000