3W53

Crystal structure of psychrophilic beta-glucosidase BglU from Micrococcus antarcticus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2011-09-27
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.5418
Spacegroup name	C 2 2 21
Unit cell lengths	57.280, 84.670, 184.770
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.443 - 2.200
R-factor	0.1632
Rwork	0.161
R-free	0.19970
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2z1s
RMSD bond length	0.007
RMSD bond angle	1.070
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHASES
Refinement software	PHENIX ((phenix.refine: 1.7.3_928))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	61.550	2.320
High resolution limit [Å]	2.200	2.200
Rmerge	0.039	0.073
Number of reflections	22807
<I/σ(I)>	32.6	14.2
Completeness [%]	97.9	87.4
Redundancy	6.4	3.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	289	0.2(mol/L) MgCl2, 30% PEG4000, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 289K