7A67

Pcc1Pcc2 complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 2
Synchrotron site	SOLEIL
Beamline	PROXIMA 2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-09-14
Detector	DECTRIS EIGER2 X 9M
Wavelength(s)	0.980066
Spacegroup name	P 32 2 1
Unit cell lengths	69.898, 69.898, 92.751
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	34.950 - 3.180
R-factor	0.192
Rwork	0.185
R-free	0.25000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3enc
RMSD bond length	0.010
RMSD bond angle	1.250
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	BUSTER (2.10.3)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	34.950	34.950	3.360
High resolution limit [Å]	3.170	9.240	3.170
Rmerge	0.212	0.070	1.796
Rmeas	0.218	0.073	1.847
Total number of observations	87363
Number of reflections	4659	219	678
<I/σ(I)>	10.93	37.93	1.54
Completeness [%]	98.4	98.2	91
Redundancy	18.751	17.301	17.488
CC(1/2)	0.997	0.998	0.859

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	15% PEG 6000 and 5% glycerol