5JBK

Trichoderma harzianum GH1 beta-glucosidase ThBgl1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	LNLS BEAMLINE W01B-MX2
Synchrotron site	LNLS
Beamline	W01B-MX2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-07-01
Detector	DECTRIS PILATUS 2M-F
Wavelength(s)	1.46
Spacegroup name	P 21 21 21
Unit cell lengths	94.860, 97.722, 106.227
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	71.920 - 2.593
R-factor	0.2155
Rwork	0.213
R-free	0.25390
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3ahy
RMSD bond length	0.004
RMSD bond angle	0.634
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.10.1-2155_1692)

Data quality characteristics

	Overall
Low resolution limit [Å]	71.920
High resolution limit [Å]	2.590
Number of reflections	31180
<I/σ(I)>	8.3
Completeness [%]	99.7
Redundancy	2.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	291	0.2 M hexahydrated magnesium chloride, 0.1M HEPES pH 7.5 and 25% PEG3350