6AKW

Crystal structure of RNA dioxygenase bound with an inhibitor

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-02-27
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9735
Spacegroup name	H 3
Unit cell lengths	141.388, 141.388, 83.608
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	28.745 - 2.200
R-factor	0.2144
Rwork	0.212
R-free	0.25440
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4qkn
RMSD bond length	0.002
RMSD bond angle	0.651
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.280
High resolution limit [Å]	2.200	2.200
Number of reflections	31725	3187
<I/σ(I)>	27.3
Completeness [%]	100.0
Redundancy	7.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION		293	100 mM sodium citrate, 12% PEG 3350, 8% isopropanol