6IS9

Crystal Structure of ZmMOC1

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	2018-01-13
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.978
Spacegroup name	P 21 21 21
Unit cell lengths	46.373, 74.604, 97.381
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.868 - 1.860
R-factor	0.1762
Rwork	0.174
R-free	0.20940
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.940
High resolution limit [Å]	1.800	3.880	1.860
Rmerge	0.123	0.052	0.963
Rmeas	0.131	0.056	1.024
Rpim	0.044	0.019	0.343
Number of reflections	31645	3368	3101
<I/σ(I)>	6.5
Completeness [%]	99.5	99.1	99.5
Redundancy	8.5	8.1	8.6
CC(1/2)		0.998	0.837

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	7.6	298	0.07 M Bis-tris propane pH 7.6, 20% PEG 3350, 0.03 M citrate acid