6FLW

Structure of AcmJRL, a mannose binding jacalin related lectin from Ananas comosus.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-06-09
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.214580
Spacegroup name	P 21 21 21
Unit cell lengths	68.069, 86.013, 88.928
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.464 - 1.800
R-factor	0.148
Rwork	0.146
R-free	0.18300
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1x1v
RMSD bond length	0.005
RMSD bond angle	0.815
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.10_2152: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.800	1.900
High resolution limit [Å]	1.800	1.800
Rmerge	0.103	0.810
Number of reflections	49023
<I/σ(I)>	15	2.7
Completeness [%]	100.0	100
Redundancy	7.4	7.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	15% PEG3000, 0.1M citrate pH5.5; protein solution 17mg/ml in H2O