7BPG

Structure of serinol nucleic acid - RNA complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL44XU
Synchrotron site	SPring-8
Beamline	BL44XU
Temperature [K]	95
Detector technology	PIXEL
Collection date	2019-10-18
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.919744
Spacegroup name	P 1 21 1
Unit cell lengths	40.363, 46.918, 47.540
Unit cell angles	90.00, 114.54, 90.00

Refinement procedure

Resolution	20.000 - 1.700
R-factor	0.234
Rwork	0.232
R-free	0.27100
Structure solution method	MAD
RMSD bond length	0.010
RMSD bond angle	1.568
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	AutoSol
Refinement software	REFMAC (5.8.0266)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.920	1.730
High resolution limit [Å]	1.700	1.700
Rmerge	0.052	0.970
Rmeas	0.062	1.144
Rpim	0.032	0.600
Number of reflections	17920	917
<I/σ(I)>	14.3	2
Completeness [%]	99.8	98.5
Redundancy	3.5
CC(1/2)	0.998	0.734

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293	25% PEG 400, 0.1M HEPES (pH6.5), 75mM Calcium chloride