5MM0

Dolichyl phosphate mannose synthase in complex with GDP-mannose and Mn2+ (donor complex)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-11-29
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.8600
Spacegroup name	C 2 2 21
Unit cell lengths	90.670, 146.320, 95.090
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.599 - 2.300
R-factor	0.2217
Rwork	0.219
R-free	0.25750
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5mlz
RMSD bond length	0.011
RMSD bond angle	1.378
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.600	2.400
High resolution limit [Å]	2.300	2.300
Number of reflections	28132
<I/σ(I)>	20.1	1.6
Completeness [%]	98.7	99.5
Redundancy	12.7
CC(1/2)		0.669

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	277	0.2 M potassium chloride, 0.1 M trisodium citrate (pH 5.5), 37% (v/v) pentaerythritol propoxylate (5/4 PO/OH), 50 mM Hepes (pH 7.5), 150 mM NaCl, 10% (v/v) glycerol, 0.05% LDAO, 5 mM GDP-mannose, 5 mM MnCl2