5MK9

Maltodextrin binding protein MalE1 from L. casei BL23 bound to beta-cyclodextrin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.1
Synchrotron site	BESSY
Beamline	14.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-12-17
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.91841
Spacegroup name	P 21 21 21
Unit cell lengths	52.137, 74.895, 90.075
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	26.068 - 0.919
R-factor	0.1094
Rwork	0.109
R-free	0.12180
Structure solution method	SAD
RMSD bond length	0.008
RMSD bond angle	1.221
Data reduction software	XDS (VERSION November 3, 2014)
Data scaling software	XDS (VERSION November 3, 2014)
Phasing software	SHELXDE (2013/2)
Refinement software	PHENIX ((1.10.1-2155_1168: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.120	0.950
High resolution limit [Å]	0.919	0.919
Rmerge	0.067	1.136
Number of reflections	232000
<I/σ(I)>	23.1	2
Completeness [%]	95.1	87.64
Redundancy	12.82	11.46
CC(1/2)		0.668

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	291	0.1 mM Na-Hepes, pH 7.0, 20-25% Jeffamine ED2003, pH 7.0, 5 mM beta-cyclodextrin / 1% polyethylene glycol 3350