7MGP

CmcA from Type II Cut MCP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-08-18
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9786
Spacegroup name	P 6
Unit cell lengths	68.860, 68.860, 27.780
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	59.630 - 1.650
R-factor	0.2141
Rwork	0.212
R-free	0.23330
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4qiv
RMSD bond length	0.008
RMSD bond angle	1.020
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER (2.8.3)
Refinement software	BUSTER

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	59.630	59.630	1.690
High resolution limit [Å]	1.650	7.380	1.650
Rmerge	0.066	0.044	0.647
Rmeas	0.069	0.047	0.685
Total number of observations	91175
Number of reflections	9272	119	677
<I/σ(I)>	19.49	45.06	3.14
Completeness [%]	100.0	100	100
Redundancy	9.833	9.403	9.632
CC(1/2)	0.999	0.999	0.910

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		294	2.5 M Sodium chloride, 0.1 M Imidazole/ Hydrochloric acid pH 8.0