9REZ

Structure of PcuC from Cereibacter sphaeroides in its apo form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-04-05
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9184
Spacegroup name	P 43 21 2
Unit cell lengths	48.100, 48.100, 110.660
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.113 - 1.050
Rwork	0.184
R-free	0.20070
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.015
RMSD bond angle	1.874
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0415)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.000	1.080
High resolution limit [Å]	1.050	1.050
Number of reflections	61356	4277
<I/σ(I)>	17.8
Completeness [%]	99.6
Redundancy	20
CC(1/2)	0.990	0.530

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	1.2M NaCitrate Tris pH 8.5