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GtfC Enzyme of Geobacillus sp. 12AMOR1 represents a novel thermostable type of GH70 4,6-Glucanotransferase that synthesizes a linear alternating (α1 → 6)/(α1 → 4) α-Glucan and delays bread staling.

24 August 2021 - J. Agric. Food Chem. 69: 9859-9868.
Authors: E.M. te Poele, S.E. van der Hoek, A.C. Chatziioannou, G.J. Gerwig, W.J. Duisterwinkel, L.A.A. C.M. Oudhuis, J. Gangoiti, L. Dijkhuizen, H. Leemhuis

Abstract

Starch-acting α-glucanotransferase enzymes are of great interest for applications in the food industry. In previous work, we have characterized various 4,6- and 4,3-α-glucanotransferases of the glycosyl hydrolase (GH) family 70 (subfamily GtfB), synthesizing linear or branched α-glucans. Thus far, GtfB enzymes have only been identified in mesophilic Lactobacilli. Database searches showed that related GtfC enzymes occur in Gram-positive bacteria of the genera Exiguobacterium, Bacillus, and Geobacillus, adapted to growth at more extreme temperatures. Here, we report characteristics of the Geobacillus sp. 12AMOR1 GtfC enzyme, with an optimal reaction temperature of 60 °C and a melting temperature of 68 °C, allowing starch conversions at relatively high temperatures. This thermostable 4,6-α-glucanotransferase has a novel product specificity, cleaving off predominantly maltose units from amylose, attaching them with an (α1 → 6)-linkage to acceptor substrates. In fact, this GtfC represents a novel maltogenic α-amylase. Detailed structural characterization of its starch-derived α-glucan products revealed that it yielded a unique polymer with alternating (α1 → 6)/(α1 → 4)-linked glucose units but without branches. Notably, this Geobacillus sp. 12AMOR1 GtfC enzyme showed clear antistaling effects in bread bakery products.

Introduction

A diversity of starch-acting enzymes are applied in the food

industry.1,2 Most of them hydrolyze starches and belong to

glycosyl hydrolase (GH) family 13.3 Also, starch-acting 4-α-

glucanotransferase enzymes are known (found in families

GH13, GH77), mostly catalyzing disproportionation reactions

(e.g., amylomaltase,4,5 cyclodextrin glucanotransferase6), thus

modifying starches but largely maintaining their highmolecular-

mass properties.7,8 In recent years, we have

characterized various family GH70 α-glucanotransferases

from subfamilies GtfB, GtfC, and GtfD.9 These enzymes are

4,6- and 4,3-α-glucanotransferases that catalyze the cleavage of

(α1 → 4)-linkages in amylose/amylopectin and maltodextrins

and introduce glucose units with (α1 → 6)-10 or (α1 → 3)-

linkages,11 respectively. The carbohydrates made by these

enzymes from starch are soluble and have clearly reduced

digestibility, making these products of interest for food

applications.12−14

The well-characterized GtfB enzyme of Limosilactobacillus

reuteri 121 is the first representative of such a 4,6-α-

glucanotransferase.10 Following cleavage of (α1 → 4)-linkages

in amylose (from the nonreducing end of donor molecules),

GtfB introduces linear (α1 → 6)-glucan segments to the

nonreducing end of acceptor molecules. This results in the

synthesis of isomaltose/maltose polysaccharide (IMMP), a

linear α-glucan polymer.15,16 Similar to the L. reuteri 121 GtfB

enzyme, the GtfC 4,6-α-glucanotransferase from Exiguobacterium

sibiricum was found to cleave the (α1 → 4)-linkages of

starch-like substrates and synthesize consecutive (α1 → 6)-

linkages. The Euastrum sibiricum GtfC activity, however, results

in the synthesis of oligosaccharides (designated as isomaltomalto/

oligosaccharides, IMMOs), instead of polymeric material.

Later on, 4,6-α-glucanotransferases producing reuteranlike

polymers from amylose have been found in GtfB and GtfD

subfamilies. Unlike IMMP and IMMO, reuteran consists of

(α1 → 4)-glucan segments interconnected by single (α1 → 6)

linkages in linear or branched orientations.13,17−19

GtfB enzymes thus far have only been identified in

mesophilic lactic acid bacteria,9,13 whereas GtfD enzymes

were found in taxonomically diverse plant-associated bacteria.

9,18,19 Interestingly, database searches showed that the

related GtfC 4,6-α-glucanotransferase enzymes occur in Grampositive

bacteria of the genera Exiguobacterium,17 Bacillus,17

and Geobacillus,9 adapted to growth at more extreme (low and

high) temperatures. Enzymes of thermophilic bacteria may be

more thermostable, allowing starch conversions at relatively

high temperatures. One field of application for such more

thermostable enzymes would be bread baking. The only 4,6-α-

glucanotransferase that has been tested in bread baking is the

Streptococcus thermophilus GtfB, slightly improving textural

properties and increasing the fraction of slowly digestible

starch of bread.20 This S. thermophilus GtfB, however, has the

highest activity at 40 °C and rapidly lost activity at higher

temperatures,21 e.g., before starch gelatinization occurred.

More thermostable starch-acting GtfC enzymes also may

display clear antistaling properties in bread products.

Bread has been an important food for thousands of years,

not only because of the energy and nutrients it delivers but also

because of its pleasant aroma, taste, and mouthfeel.

Unfortunately, the freshness of bread is lost rapidly, in a

process called staling, limiting the shelf-life of bread. Staling

starts directly after baking and involves both chemical and

physical changes that negatively affect the taste, aroma, and

mouthfeel of bread.22,23 Immediately after baking, the starch is

gelatinous, but upon cooling and over time, it starts to

retrograde/recrystallize, reducing the elasticity and increasing

the hardness of the bread crumb, which is a major indicator of

bread staling. In gluten-free breads, the staling is even

considerably faster,24 further increasing the demand for

antistaling agents, such as sugars, emulsifiers, and fats.25 Also,

starch-acting enzymes capable of trimming the exterior side

chains of the amylopectin, thereby strongly reducing the

process of starch retrogradation, are widely used as antistaling

agents.23 It is key that these enzymes only trim the exterior side

chains, without destroying the high-molecular-mass property of

the amylopectin. Therefore, exo-acting starch hydrolases such

as maltogenic α-amylase are the preferred antistaling

enzymes.26,27 On top of that, the enzyme should be active

around and above the starch gelatinization temperature (∼65

°C) but, at the same time, be inactivated by the temperature

reached at the end of the baking process (nearly 100 °C) to

avoid the presence of an active enzyme in the final bread

product.

Geobacillus sp. 12AMOR1 is a thermophilic bacterium

isolated from a 90 °C hot deep-sea sediment sample.28 It

encodes a putative GtfC enzyme.4 Characterization of this

GtfC enzyme as thermostable 4,6-α-glucanotransferase showed

that it possesses a novel maltose-transferring product

specificity, and its activity results in clear antistaling properties

in bread bakery products.

Materials and Methods

Protein Sequence Analysis and Cloning of the Geobacillus

GtfC Gene. The nucleotide and protein sequence of the Geobacillus

sp. 12AMOR1 GtfC encoding gene and enzyme (AKM18207.1) were

retrieved from the NCBI database. Its

putative signal peptide-encoding sequence was predicted using the

Signal P5 server.

Searches for conserved domains were done by using the Pfam server

and by comparing them to the conserved domains of the GtfC protein

of E. sibiricum 255-15 (ACB62096.1). For this, the GtfC protein

sequences were aligned by MUSCLE in MEGA 729 using default

parameters and analyzed with Jalview 2.10.3b1.30 The DNA fragment

encoding domains A, B, C, and IV (amino acids 33−738) was

amplified by PCR (forward 5′-CAGGGACCCGGTTATAGCTCCGGCCCGGAATTG-

3′ and reverse 5′- CGAGGAGAAGCCCGGTTACGCCTTATCCTTCGTCGGCA-

3′) from

Geobacillus sp. 12AMOR1 (DSM 17290) genomic DNA (DSMZ,

Braunschweig, Germany) with Phusion DNA polymerase (Thermo

Fisher, The Netherlands) and cloned into a modified pET15b vector

by ligation-independent cloning (LIC). The construct (pET15b-gtfC

12AMOR1) was verified by nucleotide sequencing (GATC, Cologne,

Germany) and transformed into Escherichia coli BL21 Star (DE3).

GtfC Protein Expression and Purification. Luria broth (LB)

medium supplemented with ampicillin (100 mg/L) was inoculated

with 1% (v/v) of an overnight culture of E. coli BL21 (DE3) with the

pET15b-gtfC 12AMOR1 and grown at 37 °C under shaking (200

rpm). A pET15b vector carrying the gtf B gene of L. reuteri 121

(pET15b-gtf B-ΔN-ΔV encoding GtfB-ΔN-ΔV, residues 762−1619-

His6)31 and an empty pET15b vector (negative control) were

expressed and purified using the same conditions as for the Geobacillus

gtfC construct. Expression was induced by the addition of 0.1 mM

IPTG, and incubation was continued for 20 h at 18 °C, 160 rpm.

Cells were harvested by centrifugation at 4 °C at 10 875g for 15 min

and washed once with 20 mM Tris−HCl, pH 8 plus 1 mM CaCl2.

From the Geobacillus GtfC culture, negative control, and GtfB culture,

respectively, 8, 7, and 10 grams of wet cell pellet per liter LB were

obtained. Pellets were stored at −20 °C or immediately used for

protein isolation. To this end, pellets were resuspended in washing

buffer (50 mM Tris−HCl, pH 8; 250 mM NaCl; 1 mM CaCl2; 0.25%

(v/v) Triton X; 5 mM β-ME) and broken by sonication (Soniprep,

9.5 mm probe, 12 μm amplitude, 6 cycles of 30 s on and 60 s off).

During sonication, the cell suspensions were kept on ice. Cell lysates

were centrifuged at 4 °C at 17 226g for 15 min, and the cell-free

extracts (CFEs) were stored at 4 °C. To determine whether the

proteins were expressed successfully, the CFEs were analyzed by SDSPAGE

(Supporting Information Figure S1). The Geobacillus GtfC and

GtfB-ΔN-ΔV constructs were purified by Ni2+-nitrilotriacetic acid

(NTA) affinity chromatography.19 Proteins were desalted using an

Amicon size-exclusion column (30 kDa MWCO) and desalting buffer

(20 mM Tris−HCl, pH 8; 1 mM CaCl2) (Supporting Information

Figure S1). Protein concentrations were determined by the Bradford

assay or by measuring the absorbance at 280 nm using a NanoDrop

2000 spectrophotometer (Isogen Life Science, De Meern, The

Netherlands).

Standard Reaction Buffer. All enzymatic reactions were

performed at 40 °C in 25 mM sodium citrate buffer, pH 6.0,

containing 1 mM CaCl2 unless mentioned otherwise.

Enzyme Activity Assays to Determine pH and Temperature

Optima. The Geobacillus GtfC activity was determined by measuring

the initial rate in the presence of 0.125% (w/v) amylose V (Avebe,

The Netherlands) using the amylose−iodine staining method.17,31

Assays were performed with 50 μg/mL enzyme in a reaction buffer at

40 °C. The decrease in absorbance (660 nm) of the α-glucan−iodine

complex resulting from transglycosylation and/or hydrolytic activity

was monitored for the first 6.5 min. One unit of activity was defined as

the amount of amylose V (mg) converted by 1 mg of enzyme per

minute. The pH profile and optimum pH of the Geobacillus GtfC

were determined in a reaction buffer with different pH values between

4.0 and 7.5. The temperature optimum of Geobacillus GtfC was

determined with 50 μg/mL enzyme and 0.125% amylose V at varying

temperatures between 40 and 80 °C. The thermostability was

investigated by measuring the residual enzyme activity after

incubation at 60 °C for different time periods. To this end, 50 μg/

mL enzyme was incubated in a reaction buffer in the absence of

amylose V for 0, 10, 30, and 60 min at 60 °C and pH 6.0 and then

immediately cooled to 4 °C. The residual enzyme activity was

measured at 40 °C with 0.125% amylose V. All enzymatic assays were

performed in quadruple.

Differential Scanning Fluorimetry Assay. The melting temperature

of Geobacillus GtfC was determined using the ThermoFluor

method.32 A real-time-PCR thermocycler was used to denature the

protein and measure the fluorescence. The stock solution of SYPRO

Orange (Thermo Fisher, The Netherlands) was diluted 100 times; 5

μL of this solution was added to 45 μL of 0.5 mg/mL enzyme in 20

mM Tris−HCl, pH 8, plus 1 mM CaCl2 (in duplicate). The

temperature was increased from 20 to 99 °C with 0.5 °C increments.

After incubation for 10 s, the fluorescence of SYPRO Orange was

measured.

Synthesis and Isolation of Geobacillus GtfC Products. The

purified Geobacillus GtfC (40 μg/mL) was incubated with 25 mM

maltoheptaose (G7), 0.5% amylose V, or 1% amylopectin (Eliane 100,

Avebe, The Netherlands) for 24 h (amylopectin 48 h). Reactions

were stopped by heating at 95 °C for 10 min. Incubations of 25 mM

G7 or 0.5% amylose V with GtfB-ΔN-ΔV were done as described for

Geobacillus GtfC, with the exception that reactions were performed in

25 mM sodium acetate buffer at pH 5.0. The amylose V incubations

were dialyzed in snakeskin tubing (MWCO for proteins of 3.5 kDa;

ThermoScientific) for 48 h against running tap water and for 24 h

against 20 L MilliQ water, after which the dialyzed material was

lyophilized. The Geobacillus GtfC products from amylopectin were

analyzed by TLC and NMR spectroscopy without prior dialysis.

Geobacillus GtfC Product Analysis with Hydrolytic Enzymes.

The purified α-glucan polymer produced by Geobacillus GtfC was

dissolved at a concentration of 3 mg/mL in 50 mM sodium acetate

buffer, pH 5.0, and incubated separately with an excess of α-amylase

(Aspergillus oryzae; Megazyme), dextranase (Chaetomium erraticum;

Sigma-Aldrich), and pullulanase M1 (Klebsiella planticola; Megazyme)

for 24 h at 37 °C. Amylose V, dextran (MW 70 kDa; Sigma-Aldrich),

and pullulan (Megazyme) were used as positive controls for the α-

amylase, dextranase, and pullulanase treatments, respectively, resulting

in complete degradation under these conditions. The degree of

hydrolysis was examined by TLC analysis.

Thin-Layer Chromatography. For thin-layer chromatography

(TLC) analysis, samples were spotted in 1 cm lines on TLC sheets

(Merck Kieselgel 60 F254, 20 × 20 cm). Plates were developed with nbutanol/

acetic acid/water = 2:1:1 (v/v/v). Bands were visualized by

orcinol/sulfuric acid staining and compared with a maltooligosaccharide

standard from DP1 to DP7.

High-pH Anion-Exchange Chromatography. High-performance/

pH anion-exchange chromatography (HPAEC) was performed

on an ICS-3000 workstation (Dionex, Amsterdam, The Netherlands),

equipped with an ICS-3000 ED pulsed amperometric detection

system (PAD). Samples were diluted 1:100 in MilliQ water and

filtered through a 0.2 μm cellulose filter prior to injection (25 μL

injection volume). The oligosaccharides were separated on a

CarboPac PA-1 column (Dionex; 250 × 2 mm) by using an isocratic

gradient of 100 mM NaOH for 5 min, followed by a linear gradient of

0−270 mM sodium acetate in 100 mM NaOH over 30 min with a

flow of 0.25 mL/min. The gradient was followed by a cleaning step

and a re-equilibration step to the starting conditions of the analysis.

Commercial oligosaccharide standards were used to identify the

peaks.

High-Performance Size-Exclusion Chromatography. The

molecular mass distribution of the purified Geobacillus GtfC polymer

was determined by high-performance size-exclusion chromatography

(HPSEC), as described previously.11 The HPSEC system (Agilent

Technologies 1260 Infinity) was equipped with a multiangle laser

light scattering detector (SLD 7000 PSS, Mainz, Germany), a

viscometer (ETA-2010 PSS, Mainz), and a differential refractive index

detector (G1362A 1260 RID Agilent Technologies). Separation was

performed by using three PFG-SEC columns with porosities of 100,

300, and 4000 Å, coupled with a PFG guard column. DMSO-LiBr

(0.05 M) was used as an eluent at a flow rate of 0.5 mL/min. The

system was calibrated and validated using a standard pullulan kit

(PSS, Mainz, Germany), with Mw ranging from 342 to 708 000 Da.

The specific RI increment (dn/dc) value for pullulan was determined

as 0.072 mL/g (PSS, Germany). The dn/dc value for the GtfC

polysaccharide in this system was taken to be the same as for pullulan.

The molecular mass (MW) was determined by the universal

calibration method. WinGPC Unity software (PSS, Mainz) was

used for data processing.

Methylation Analysis. Samples (in triplicate) were permethylated

using CH3I and solid NaOH in (CH3)2SO, as described

previously,33 and then hydrolyzed with 2 M trifluoroacetic acid (2 h,

120 °C) to give the mixture of partially methylated monosaccharides.

After evaporation to dryness, the mixture was dissolved in H2O and

was reduced with NaBD4 (2 h, room temperature). Subsequently, the

solution was neutralized with 4 M acetic acid and boric acid was

removed by repeated coevaporation with methanol. The obtained

partially methylated alditol samples were acetylated with 1:1 (v/v)

acetic anhydride−pyridine (30 min, 120 °C). After evaporation to

dryness, the mixtures of partially methylated alditol acetates

(PMAAs), dissolved in dichloromethane, were analyzed by GLC-EIMS

on an EC-1 column (30 m × 0.25 mm; Alltech), using a GCMSQP2010

Plus instrument (Shimadzu Kratos Inc., Manchester, U.K.)

and a temperature gradient (140−250 °C at 8 °C/min).34

NMR Spectroscopy. The freeze-dried polymer sample was

exchanged twice in 500 μL of D2O (99.9 atom % D, Cambridge

Isotope Laboratories, Inc., Andover, MA) with intermediate

lyophilization and finally dissolved in 650 μL of D2O, spiked with

0.005% of acetone as an internal standard. One-dimensional (1D) 1H,

two-dimensional (2D) TOCSY (200 ms), and 2D natural abundance

1H−13C HSQC spectra (1H frequency of 600.13 MHz, 13C frequency

of 150.91 MHz) were recorded on a Bruker 600 MHz spectrometer

(NMR Center, University of Groningen) at a probe temperature of

300 K. The NMR data were processed using the MestReNova 12

program (Mestrelab Research SL, Santiago de Compostella, Spain).

Chemical shifts (δ) were expressed in ppm by reference to internal

acetone (δ 2.225 for 1H and δ 31.08 for 13C).

Gluten-Free Bread Baking. The dry ingredients (Supporting

Information Table S1), except the yeast, were mixed into a

homogeneous mixture by hand. The mixture was added to a bowl

containing the oil, and the contents were mixed for 1 min at gear 1 of

a Hobart mixer with a flat beater (Hobart N50 planetary mixer,

Hobart Corporation, Troy, Ohio). The yeast was added, and mixing

was continued for 1 additional min. Subsequently, the water of 39 °C,

with or without enzyme, was added while mixing for 2 min. Then, the

batter was kneaded by hand and mixed at gear 1 for 2 min and then 6

min at gear 2. Batter pieces of 300 g were placed in a baking tin and

incubated at 30 °C with a relative moisture content of 90% for 30 min

for proofing. Baking profile: 30 min at 235 °C upper and 245 °C of

bottom temperature, with two steam injections in advance.

Wheat Bread Baking. The dry ingredients (Supporting

Information Table S2), except the yeast, were mixed into a

homogeneous mixture using a Diosna spiral mixer (Diosna SP24,

Diosna Dierks & Söhne GmbH, Osnabrück, Germany). The yeast w

hair was added, and mixing was continued until a homogeneous

mixture was obtained. Subsequently, the water of 40 °C, with or

without enzyme, was added and the dough was mixed for 4 min at low

speed. Oil was added and mixed for 1 additional min. Then, the

dough was mixed for 8 min at high speed yielding a solid dough. The

dough was divided into pieces of 220 g and fermented at 26−28 °C

for 60 min with a relative moisture content of 80−90%. The gas was

pressed out of the dough, shaped, and fermented again under the

same conditions for 50 min. Baking profile: an initial temperature of

220 °C, a baking temperature of 200 °C for 50 min, with two steam

injections in advance.

Texture Analysis. The hardness of the bread crumbs was

measured using the EZ-SX Texture Analyzer of Shimadzu (The

Netherlands). Cylindrical shaped pieces with a diameter of 4.5 cm

were taken from the center of 2.0 cm thick slices. They were

compressed at a speed of 1 mm/s, a total distance of 3 mm in case of

gluten-free bread and 4 mm in case of wheat bread, with a cylindrical

probe (P75; diameter 7.5 cm). The hardness of the crumb is defined

as the maximum peak force encountered (gram-force) during the

compression, average of four measurements.

Results and Discussion

Phylogenetic Analysis, Domains Present, and Order

of Conserved Motifs. Phylogenetic analysis showed that

Geobacillus sp. 12AMOR1 GtfC clusters with GtfC-like 4,6-α-

glucanotransferases. There is a 56% sequence identity to the

well-characterized GtfC protein of E. sibiricum 255-159,17 and a

60% sequence identity to the very recently characterized

Bacillus coagulans DSM 1 GtfC.35 The E. sibiricum GtfC

protein was the first example of a new subfamily within family

GH70, with a different domain order than the GtfB-type

enzymes and the glucansucrase enzymes (with both α-amylase

domains A, B, and C and domains IV and V). In fact, the GtfClike

proteins lack domain V and have the same domain

organization as the GH13 enzymes.17 Compared to GH13

enzymes, the (β/α)8 barrel of the GtfB-type and glucansucrase

enzymes is circularly permutated, causing an altered order of

the conserved regions (II−III−IV−I). Similar to the GtfC

protein of E. sibiricum, Geobacillus GtfC has two extra Ig2-like

domains with unknown function (Figure 1). The Geobacillus

GtfC protein (726 AA, 82 kDa) with complete domains A, B,

C, and IV, but lacking the Ig2-like domains, was produced,

yielding about 30 mg of purified GtfC protein per liter of

culture, which was used in all subsequent studies described

here.

Substrate Specificity and Biochemical Properties of

the Geobacillus GtfC. Maltoheptaose (G7) and amylose V

were individually incubated with Geobacillus GtfC, and the

products formed were analyzed by TLC and HPAEC-PAD.

Reactions with the truncated L. reuteri 121 GtfB enzyme

lacking the N-terminal and domain V (GtfB-ΔN-ΔV) were

performed in parallel. The analyses showed that Geobacillus

GtfC synthesized a range of shorter and longer oligosaccharides

from G7, reflecting its main disproportionation (transglycosidase)

activity (Figures 2A and 3A). However, its

product spectrum is very different from that of GtfB-ΔN-ΔV

(Figure 2A), which synthesizes linear products with consecutive

(α1 → 6)-linkages.15 GtfC did not form polymeric

material from G7, unlike GtfB-ΔN-ΔV. Furthermore, GtfB-

ΔN-ΔV released a significant amount of glucose from G7,

whereas Geobacillus GtfC mainly released maltose but not

glucose. When acting on amylose V, Geobacillus GtfC

accumulated considerably higher amounts of oligosaccharides

than GtfB-ΔN-ΔV, which mainly synthesized polymeric

material (Figure 2B).

HPAEC-PAD analysis showed that Geobacillus GtfC mainly

released maltose from amylose V and only a small amount of

G3 (Figure 3B). It has to be noted that peaks are present that

do not correspond to the G1−G7 peaks [standards containing

only (α1 → 4)-linkages], suggesting product oligosaccharides

with different linkages. TLC (Figure 2B) shows that besides

small oligosaccharides, Geobacillus GtfC also synthesized

polymeric material from amylose V, clearly differing from the

E. sibiricum GtfC only forming oligosaccharides. The polymeric

material produced by Geobacillus GtfC was further investigated

with HPSEC (see below).

Geobacillus GtfC displayed high activity within the pH range

4.5−7.0 at 40 °C, with a maximum activity of 4.1 U/mg at pH

6.0 (Figure 4A). At the optimal pH of 6.0, the activity of

Geobacillus GtfC increased with increasing temperature,

reaching 6.6 U/mg at 60 °C, and then gradually decreased

to 3 U/mg at 75 °C (Figure 4B). The activity of the

Geobacillus GtfC enzyme on amylose V is significantly higher

than that of GtfB-ΔN-ΔV (2.8 U/mg) and GtfC of E. sibiricum

(2.2 U/mg) on amylose V.17,36 Furthermore, Geobacillus GtfC

hardly lost any activity when incubated for 1 hour at 60 °C in

the absence of substrate (Figure 4C), showing that it is a

thermostable enzyme. GtfC was rapidly inactivated at 95 °C

(data not shown). The thermal unfolding of Geobacillus GtfC

was determined by differential scanning fluorimetry and

revealed a melting temperature of 68 °C, supporting its high

thermostability (Figure 4D).

Geobacillus GtfC Has a Unique Product Specificity,

Synthesizing a Linear (α1 → 6)/(α1 → 4)-Glucan. The

polymeric fraction resulting from the Geobacillus GtfC activity

on amylose was isolated and characterized in detail. As

revealed by HPSEC analysis, the Geobacillus GtfC synthesized

a low-molecular-mass polymer from amylose V with an average

MW of 2.5 kDa (Figure 5), equivalent to a degree of

polymerization (DP) of ∼15. This polysaccharide is much

smaller than the IMMP produced by the GtfB-ΔN-ΔV from

amylose (MW of ∼ 12.3 kDa) (Figure 5).

The GtfC polymer was treated with a high dose of hydrolytic

enzymes, α-amylase (Aspergillus oryzae), dextranase (Chaetomium

erraticum), and pullulanase M1 (Klebsiella planticola), to

further explore its structure (Figure 6). TLC analysis showed

that the Geobacillus GtfC polymer is almost completely

resistant to the endo-(α1 → 4)-hydrolase action of α-amylase,

whereas amylose V is completely hydrolyzed. The GtfC

polymer also appeared mostly resistant to the endo-(α1 → 6)-

hydrolase activity of dextranase (completely hydrolyzing

dextran), indicating the absence of consecutive (α1 → 6)-

linkages. The GtfC polymer (and pullulan) was efficiently

hydrolyzed by pullulanase M1, which cleaves alternating (α1

→ 6)/(α1 → 4)-linkages and (α1 → 4,6)-branching points.

Pullulanase M1 treatment yielded mostly maltose as the

hydrolysis product. These results suggest that the Geobacillus

GtfC polymer mostly contains consecutive maltose units linked

by single (α1 → 6)-bonds. In accordance with this structural

analysis, the GtfC enzyme thus cleaves off mainly maltose units

from the linear (α1 → 4)-chain of amylose V donor molecules

and reattaches these to α-glucan acceptor molecules (e.g.,

amylose V, maltose formed by the hydrolytic side reaction, or

earlier formed transglucosylation products) with an (α1 → 6)-

linkage. Whereas the 4-α-glucanotransferase enzymes of

families GH13 and 77 may be able to transfer maltose units

(disproportionation reactions), the maltose transfer by the

family GH70 Geobacillus GtfC 4,6-α-glucanotransferase clearly

represents a novel product specificity, creating an (α1 → _____6)-

linkage with transfer and reattachment of every maltose unit.

To structurally characterize the 2.5 kDa polymer produced

by the Geobacillus GtfC from amylose V in more detail, 1D/2D

1H−13C NMR spectroscopy was performed (Figure 7). The

assignments of protons and carbons were obtained by

TOCSY/HSQC experiments and comparison of chemical

shift values to literature values.11,15,37−39

Further significant signals are at δ 4.02 [H-3 of →4)Glc(α1

→ 6)], at δ 3.48 [H-4 of →6)Glc(α1 → 4)], and at δ 3.42 [H-

4 of nonreducing end Glc(α1 → 4)]. The 2D 1H−13C HSQC

spectrum shows proton/carbon signals of unsubstituted C-6 at

δC 61.4, stemming from nonreducing-terminal Glc(α1 → 4)

(δH 3.85/3.76) and mainly →4)Glc(α1 → 6) (δH 3.88/3.84).

Substituted C-6 is shown by downfield-shifted signals at δC

67.2, stemming from →6)Glc(α1 → 4) (δH 3.96/3.75). There

is no →6)Glc(α1 → 6) present due to the absence of C-6 (δC

66.7) and H-6 (δH 3.98/3.76) signals.37−39 Further confirmation

of assignments was obtained by HSQC signals at δH

3.27/δC 74.9 [H-2/C-2 of reducing end →4)Glcβ], at δH 3.42/

δC 70.1 [H-4/C-4 of nonreducing end Glc(α1 → 4)], and at

δH 3.48/δC 70.4 [H-4/C-4 of →6)Glc(α1 → 4)], at δH 3.60/

δC 72.5 [H-2/C-2 of →4)Glc(α1 → 6) and nonreducingterminal

Glc(α1 → 4)]. The complete assignment is

summarized in Table 1.

So far, these results indicate a significant amount of α-glucan

polymer containing alternating (α1 → 6)/(α1 → 4)-linked

glucose units. The presence of a minor amount of substrate

amylose V left over, containing [→4)Glc(α1 → 4)], cannot be

excluded due to the known typical overlap of its proton and

carbon signals with the assigned signals above.37−39 The

anomeric proton signals at δ 5.40−5.36 could include H-1 of a

branching unit →4,6)Glc(α1 → 4), but methylation analysis

showed the absence of branching. Additionally, the presence of

terminal, 4-substituted, and 6-substituted glucopyranose

residues, in molar percentages of 9, 48, and 43%, was

confirmed by methylation analysis.

The combined data show that Geobacillus GtfC is a

thermostable 4,6-α-glucanotransferase with a unique product

specificity, cleaving off predominantly maltose units from

amylose V and reattaching them with an (α1 → 6)-linkage.

Geobacillus GtfC thus synthesizes a unique linear polymer with

alternating (α1 → 6)/(α1 → 4)-linked glucoses (see model

structure; Figure 8). Importantly, terminal Glc(α1 → 6) and

→6)Glcα/β were not detected in NMR spectra. It is the

absence of branches that mainly distinguishes the reaction

specificity of Geobacillus GtfC from that of the L. reuteri NCC

2631 GtfB, Azotobacter chroococcum NCIMB 8003, and

Paenibacillus beijingensis GtfD types of 4,6-α-glucanotransferases,

which produce heavily branched reuteran-like polymers.

13,18,19 Besides, these reuteran-producing enzymes were

found to transfer malto-oligosaccharides of different degrees of

polymerization (from 2 to 7), whereas the Geobacillus GtfC

exclusively cleaves and reattaches maltosyl units. Despite the

wide product specificity of the GH70 family, the structure of

the Geobacillus GtfC product is unique and clearly differs from

other α-glucans synthesized by GSs and 4,6-α-glucanotransferases.

Due to its linear structure and alternating (α1 → 4)/

(α1 → 6)-linkage pattern, the Geobacillus GtfC resembles

more to the pullulan polymer produced from starch by the

fungus Aureobasidium pullulans and used as a food additive.

However, pullulan is built up from maltotriose elements linked

by (α1 → 6) linkages instead of maltose units.

Geobacillus GtfC Is an Exo-Acting Enzyme. Amylopectin

was incubated with Geobacillus GtfC. TLC analysis showed

the formation of small quantities of maltose and other

oligosaccharides (mainly DP4) (Supporting Information

Figure S2A), though clearly less than formed with incubation

of amylose V with GtfC (Figure 2B, lane 2). This

demonstrated that GtfC only has a minor activity toward

amylopectin, which was confirmed by comparing the 1D 1H

NMR spectra of treated and untreated amylopectin (Supporting

Information Figure S2B). The spectra show the presence of

→4,6)Glc(α1 → 4) branching by anomeric proton signals at δ

5.36. A minimal difference is detected by the appearance of α/

β-anomeric protons (δ 5.22/4.65) and a H-2 signal (δ 3.27)

stemming from reducing-terminal →4)Glcα/β, indicating the

formation of very small amounts of malto-oligosaccharides.

Importantly, the treatment with Geobacillus GtfC did not

destroy the high-molecular-mass nature of amylopectin, with

the molecular mass remaining too high to be determined by

HPSEC analysis (data not shown). This indicates that

Geobacillus GtfC cannot bypass branches within amylopectin,

confirming the exo-acting nature of the GtfC enzyme.

Geobacillus GtfC 4,6-α-Glucanotransferase Has Antistaling

Activity. The only GH70 4,6-α-glucanotransferase

that has been tested in bread baking is the S. thermophilus GtfB,

slightly improving the textural properties and increasing the

fraction of slowly digestible starch of bread.20 The S.

thermophilus enzyme is rather different from the Geobacillus

GtfC, converting amylose in branched α-glucans,21 whereas

Geobacillus GtfC forms linear (α1 → 4)/(α1 → 6)-alternating

α-glucans. Moreover, the S. thermophilus GtfB enzyme has no

activity above 50 °C21 and thus only modifies the limited

soluble fraction of the starch during dough proofing. This is

because, in dough, starch is in its native physically inaccessible

semicrystalline granule form, going in solution at temperatures

above 65 °C40 (starch gelatinization), and only then the

enzymes can effectively attack the starch. The high thermostability

of Geobacillus GtfC, unfolding at 68 °C in the absence

of a substrate (Figure 4D), now allowed a proper evaluation of

4,6-α-glucanotransferase for antistaling activity in bread baking,

in analogy with the maltogenic amylases (e.g., Novamyl) used

within the bakery industry.41 Note that both maltogenic

amylases and Geobacillus GtfC are exo-acting enzymes cleaving

off maltose units from the nonreducing ends of linear (α1 →

4)-glucan chains. The difference being that maltogenic amylase

catalyzes hydrolysis forming maltose, whereas GtfC transfers

the maltose to an acceptor forming (α1 → 6)-glycosidic

linkages. The question arose whether Geobacillus GtfC also has

antistaling activity. The potential antistaling activity of

Geobacillus GtfC was first evaluated in a regular wheat bread,

including 7.1 kU of enzyme activity per kg of starch within the

recipe. Geobacillus GtfC did not alter the visual appearance of

the baked breads nor did it change the specific volume or the

crumb appearance (Figure 9). Nevertheless, the texture of the

bread improved, with the hardness of the Geobacillus GtfC

breads increasing slowly over time and being softer at each

time point (Figure 9). Thus, Geobacillus GtfC has a clear

antistaling activity in wheat breads.

Subsequently, Geobacillus GtfC was evaluated in a glutenfree

recipe. Typically, gluten-free breads suffer from very fast

staling since they lack the elasticity provided by the gluten

network and thus more heavily rely on the elasticity provided

by the starch. Because the gluten-free recipe tested in this

study was based on potato starch, which gelatinizes at a lower

temperature than wheat starch,40 there is a wider temperature

operation window for the enzyme to act on the gelatinized

starch during baking. The recipe contained 9.6 kU of GtfC

activity per kg starch, resulting in gluten-free breads with a

good visual appearance similar to the control (Figure 10).

Geobacillus GtfC improved the crumb structure of the bread,

having a clearly finer structure compared to the control.

Moreover, the hardness of the GtfC containing gluten-free

breads increased far slower, thus maintaining the favorable soft

crumb structure over a longer period (Figure 10). Geobacillus

GtfC displays a pronounced antistaling effect in a gluten-free

bread recipe.

The question remaining for future research is to unravel how

and to what extent GtfC is changing the molecular structure of

starch during bread baking. Our current hypothesis is that the

enzyme forms small quantities of the same type of (α1 → 4)/

(α1 → 6)-alternating oligosaccharides in bread as generated

from low concentrations of amylose and malto-oligosaccharides.

Most likely, the Geobacillus GtfC enzyme acts on both the

amylose fraction and the side chains of the amylopectin

molecules during bread baking. This will result in shorter

exterior side chains and/or exterior side chains that have

alternating (α1 → 4)/(α1 → 6) glycosidic linkages at their

nonreducing end, both reducing the process of retrogradation.

The previously characterized E. sibiricum and B. coagulans

DSM 1 GtfC types of 4,6-α-glucanotransferases both transfer

glucose units.17,35 Unexpectedly, the Geobacillus GtfC transferred

maltose units. Evidently, the donor subsite region of this

enzyme is spacious enough to accommodate two glucose

moieties. In addition, the observation that the Geobacillus GtfC

enzyme formed small amounts of short oligosaccharides when

acting on amylopectin (Supporting Information Figure S2),

though far less than from amylose (Figure 2), suggests that its

donor subsites cannot accommodate branched donor substrates.

The Geobacillus GtfC enzyme only forms linear

products, suggesting that the acceptor subsite region is quite

narrow, preventing the formation of branched products. In

contrast, the 4,6-α-glucanotransferase of A. chroococcum

NCIMB 8003 and L. reuteri NCC 2613 converts linear

malto-oligosaccharides into branched reuteran-like α-glucans.

13,19

Only the three-dimensional (3D) structure of the 4,6-α-

glucanotransferase GtfB protein of L. reuteri 121 is currently

available.21 This enzyme also acts on linear substrates to form

linear products but transfers glucose instead of maltose units. A

structural explanation for the distinct product specificity of the

Geobacillus GtfC is currently under investigation.

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