6GH2

Paenibacillus sp. YM1 laminaribiose phosphorylase with alpha-glc-1-phosphate bound

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	2016-10-02
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9800
Spacegroup name	P 41 21 2
Unit cell lengths	146.405, 146.405, 221.860
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	75.690 - 2.500
R-factor	0.1813
Rwork	0.179
R-free	0.21750
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	6ggy
RMSD bond length	0.009
RMSD bond angle	1.340
Data reduction software	XDS
Data scaling software	Aimless (0.5.31)
Phasing software	REFMAC
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	75.690	75.690	2.550
High resolution limit [Å]	2.500	12.990	2.500
Rmerge	0.217	0.035	1.809
Rmeas	0.223	0.036	1.859
Rpim	0.051	0.009	0.424
Total number of observations	1492934
Number of reflections	83874	725	4529
<I/σ(I)>	13.6
Completeness [%]	100.0	99.6	100
Redundancy	17.8	14.8	18.2
CC(1/2)	0.998	1.000	0.624

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	Null