9J41

Crystal Structure of glucose tolerant beta-glucosidase UnBGl1 mutant (C188V)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	RRCAT INDUS-2 BEAMLINE PX-BL21
Synchrotron site	RRCAT INDUS-2
Beamline	PX-BL21
Temperature [K]	100
Detector technology	CCD
Collection date	2017-06-24
Detector	RAYONIX MX225HE
Wavelength(s)	0.97949
Spacegroup name	P 21 21 21
Unit cell lengths	51.880, 66.270, 138.250
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.760 - 1.300
R-factor	0.16904
Rwork	0.168
R-free	0.18772
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.012
RMSD bond angle	1.914
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	REFMAC (5.8.0425)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	1.400
High resolution limit [Å]	1.300	1.300
Rmerge	0.046	0.398
Number of reflections	116123	43539
<I/σ(I)>	11.69
Completeness [%]	93.6	96.4
Redundancy	2.54
CC(1/2)	0.999	0.787

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.2	295	0.056M Sodium phosphate monobasic monohydrate, 1.344M Potassium phosphate dibasic, pH 8.2