5XTT

Crystal structure of RmMan134A-M3 complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	80
Detector technology	CCD
Collection date	2016-10-15
Detector	RAYONIX MX225HE
Wavelength(s)	0.979
Spacegroup name	P 21 21 21
Unit cell lengths	49.051, 59.085, 122.092
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.500 - 1.750
Rwork	0.187
R-free	0.21660
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (dev-2474-000)

Data quality characteristics

	Overall
Low resolution limit [Å]	30.500
High resolution limit [Å]	1.750
Rmerge	0.088
Number of reflections	35620
<I/σ(I)>	10.2
Completeness [%]	97.9
Redundancy	8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	PEG 4000, HEPES Na, 2-Propanol