6E0K

Structure of Rhodothermus marinus CdnE c-UMP-AMP synthase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.1
Synchrotron site	ALS
Beamline	5.0.1
Temperature [K]	80
Detector technology	CCD
Collection date	2017-07-23
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.00001
Spacegroup name	P 21 21 21
Unit cell lengths	52.530, 66.330, 89.213
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.389 - 1.600
R-factor	0.1646
Rwork	0.164
R-free	0.18630
Structure solution method	SAD
RMSD bond length	0.006
RMSD bond angle	0.802
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.390	1.630
High resolution limit [Å]	1.600	1.600
Rpim	0.024	0.121
Number of reflections	41925	1925
<I/σ(I)>	18	4.6
Completeness [%]	99.7	95
Redundancy	6.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	10-20% ethanol, 100 mM Tris-HCl pH 7.5