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PDBsum entry 1mac

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protein metals Protein-protein interface(s) links
Hydrolase (glucanase) PDB id
1mac

 

 

 

 

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Contents
Protein chains
212 a.a. *
Metals
_CA ×2
Waters ×175
* Residue conservation analysis
PDB id:
1mac
Name: Hydrolase (glucanase)
Title: Crystal structure and site-directed mutagenesis of bacillus macerans endo-1,3-1,4-beta-glucanase
Structure: 1,3-1,4-beta-d-glucan 4-glucanohydrolase. Chain: a, b. Engineered: yes
Source: Paenibacillus macerans. Organism_taxid: 44252. Expressed in: escherichia coli. Expression_system_taxid: 562.
Resolution:
2.30Å     R-factor:   0.163    
Authors: M.Hahn,U.Heinemann
Key ref: M.Hahn et al. (1995). Crystal structure and site-directed mutagenesis of Bacillus macerans endo-1,3-1,4-beta-glucanase. J Biol Chem, 270, 3081-3088. PubMed id: 7852389
Date:
22-Dec-94     Release date:   27-Feb-95    
PROCHECK
Go to PROCHECK summary
 Headers
 References

Protein chains
Pfam   ArchSchema ?
P23904  (GUB_PAEMA) -  Beta-glucanase from Paenibacillus macerans
Seq:
Struc:
237 a.a.
212 a.a.*
Key:    PfamA domain  Secondary structure  CATH domain
* PDB and UniProt seqs differ at 1 residue position (black cross)

 Enzyme reactions 
   Enzyme class: E.C.3.2.1.73  - licheninase.
[IntEnz]   [ExPASy]   [KEGG]   [BRENDA]
      Reaction: Hydrolysis of 1,4-beta-D-glycosidic linkages in beta-D-glucans containing 1,3- and 1,4-bonds.

 

 
J Biol Chem 270:3081-3088 (1995)
PubMed id: 7852389  
 
 
Crystal structure and site-directed mutagenesis of Bacillus macerans endo-1,3-1,4-beta-glucanase.
M.Hahn, O.Olsen, O.Politz, R.Borriss, U.Heinemann.
 
  ABSTRACT  
 
In beta-glucans those beta-1,4 glycosidic bonds which are adjacent to beta-1,3 bonds are cleaved by endo-1,3-1,4-beta-glucanases (beta-glucanases). Here, the relationship between structure and activity of the beta-glucanase of Bacillus macerans is studied by x-ray crystallography and site-directed mutagenesis of active site residues. Crystal structure analysis at 2.3-A resolution reveals a jelly-roll protein structure with a deep active site channel harboring the amino acid residues Trp101, Glu103, Asp105, and Glu107 as in the hybrid Bacillus beta-glucanase H(A16-M) (Keitel, T., Simon, O., Borriss, R., and Heinemann, U. (1993) Proc. Natl. Acad. Sci. U.S.A. 90, 5287-5291). Different mutant proteins with substitutions in these residues are generated by site-directed mutagenesis, isolated, and characterized. Compared with the wild-type enzyme their activity is reduced to less than 1%. Several mutants with isosteric substitutions in Glu103 and Glu107 are completely inactive, suggesting a direct role of these residues in glycosyl bond hydrolysis. The kinetic properties of mutant beta-glucanases and the crystal structure of the wild-type enzyme are consistent with a mechanism where Glu103 and Glu107 are the catalytic amino acid residues responsible for cleavage of the beta-1,4 glycosidic bond within the substrate molecule.
 

Literature references that cite this PDB file's key reference

  PubMed id Reference
20680265 T.Takeda, M.Takahashi, T.Nakanishi-Masuno, Y.Nakano, H.Saitoh, A.Hirabuchi, S.Fujisawa, and R.Terauchi (2010).
Characterization of endo-1,3-1,4-β-glucanases in GH family 12 from Magnaporthe oryzae.
  Appl Microbiol Biotechnol, 88, 1113-1123.  
19189377 B.Mertz, X.Gu, and P.J.Reilly (2009).
Analysis of functional divergence within two structurally related glycoside hydrolase families.
  Biopolymers, 91, 478-495.  
18365147 J.Qiao, B.Dong, Y.Li, B.Zhang, and Y.Cao (2009).
Cloning of a beta-1,3-1,4-glucanase gene from Bacillus subtilis MA139 and its functional expression in Escherichia coli.
  Appl Biochem Biotechnol, 152, 334-342.  
18802694 Y.M.Cheng, T.Y.Hong, C.C.Liu, and M.Meng (2009).
Cloning and functional characterization of a complex endo-beta-1,3-glucanase from Paenibacillus sp.
  Appl Microbiol Biotechnol, 81, 1051-1061.
PDB codes: 4k35 4k3a
18459822 M.Yuki, S.Moriya, T.Inoue, and T.Kudo (2008).
Transcriptome analysis of the digestive organs of Hodotermopsis sjostedti, a lower termite that hosts mutualistic microorganisms in its hindgut.
  Zoolog Sci, 25, 401-406.  
  18678950 S.Yang, Y.Wang, Z.Jiang, and C.Hua (2008).
Crystallization and preliminary X-ray analysis of a 1,3-1,4-beta-glucanase from Paecilomyces thermophila.
  Acta Crystallogr Sect F Struct Biol Cryst Commun, 64, 754-756.  
18703845 T.Y.Hong, Y.Y.Hsiao, M.Meng, and T.T.Li (2008).
The 1.5 A structure of endo-1,3-beta-glucanase from Streptomyces sioyaensis: evolution of the active-site structure for 1,3-beta-glucan-binding specificity and hydrolysis.
  Acta Crystallogr D Biol Crystallogr, 64, 964-970.
PDB code: 3dgt
17921497 C.Deutsch, and B.Krishnamoorthy (2007).
Four-body scoring function for mutagenesis.
  Bioinformatics, 23, 3009-3015.  
17067283 D.von Wettstein (2007).
From analysis of mutants to genetic engineering.
  Annu Rev Plant Biol, 58, 1.  
17879342 G.Fibriansah, S.Masuda, N.Koizumi, S.Nakamura, and T.Kumasaka (2007).
The 1.3 A crystal structure of a novel endo-beta-1,3-glucanase of glycoside hydrolase family 16 from alkaliphilic Nocardiopsis sp. strain F96.
  Proteins, 69, 683-690.
PDB code: 2hyk
17340109 J.Dong, Y.Tamaru, and T.Araki (2007).
A unique beta-agarase, AgaA, from a marine bacterium, Vibrio sp. strain PO-303.
  Appl Microbiol Biotechnol, 74, 1248-1255.  
17213669 J.Dong, Y.Tamaru, and T.Araki (2007).
Molecular cloning, expression, and characterization of a beta-agarase gene, agaD, from a marine bacterium, Vibrio sp. strain PO-303.
  Biosci Biotechnol Biochem, 71, 38-46.  
16470364 D.Teng, J.H.Wang, Y.Fan, Y.L.Yang, Z.G.Tian, J.Luo, G.P.Yang, and F.Zhang (2006).
Cloning of beta-1,3-1,4-glucanase gene from Bacillus licheniformis EGW039 (CGMCC 0635) and its expression in Escherichia coli BL21 (DE3).
  Appl Microbiol Biotechnol, 72, 705-712.  
16292531 E.Kitamura, and Y.Kamei (2006).
Molecular cloning of the gene encoding beta-1,3(4)-glucanase A from a marine bacterium, Pseudomonas sp. PE2, an essential enzyme for the degradation of Pythium porphyrae cell walls.
  Appl Microbiol Biotechnol, 71, 630-637.  
16550377 G.Michel, P.Nyval-Collen, T.Barbeyron, M.Czjzek, and W.Helbert (2006).
Bioconversion of red seaweed galactans: a focus on bacterial agarases and carrageenases.
  Appl Microbiol Biotechnol, 71, 23-33.  
16374635 R.Kawai, K.Igarashi, M.Yoshida, M.Kitaoka, and M.Samejima (2006).
Hydrolysis of beta-1,3/1,6-glucan by glycoside hydrolase family 16 endo-1,3(4)-beta-glucanase from the basidiomycete Phanerochaete chrysosporium.
  Appl Microbiol Biotechnol, 71, 898-906.  
16421930 V.Receveur-Bréchot, M.Czjzek, A.Barre, A.Roussel, W.J.Peumans, E.J.Van Damme, and P.Rougé (2006).
Crystal structure at 1.45-A resolution of the major allergen endo-beta-1,3-glucanase of banana as a molecular basis for the latex-fruit syndrome.
  Proteins, 63, 235-242.
PDB code: 2cyg
18943787 J.D.Palumbo, G.Y.Yuen, C.C.Jochum, K.Tatum, and D.Y.Kobayashi (2005).
Mutagenesis of beta-1,3-Glucanase Genes in Lysobacter enzymogenes Strain C3 Results in Reduced Biological Control Activity Toward Bipolaris Leaf Spot of Tall Fescue and Pythium Damping-Off of Sugar Beet.
  Phytopathology, 95, 701-707.  
15936898 M.Akita, K.Kayatama, Y.Hatada, S.Ito, and K.Horikoshi (2005).
A novel beta-glucanase gene from Bacillus halodurans C-125.
  FEMS Microbiol Lett, 248, 9.  
  16508094 Z.Pang, Y.N.Kang, M.Ban, M.Oda, R.Kobayashi, M.Ohnishi, and B.Mikami (2005).
Crystallization and preliminary crystallographic analysis of endo-1,3-beta-glucanase from Arthrobacter sp.
  Acta Crystallogr Sect F Struct Biol Cryst Commun, 61, 68-70.  
15560790 A.Grassick, P.G.Murray, R.Thompson, C.M.Collins, L.Byrnes, G.Birrane, T.M.Higgins, and M.G.Tuohy (2004).
Three-dimensional structure of a thermostable native cellobiohydrolase, CBH IB, and molecular characterization of the cel7 gene from the filamentous fungus, Talaromyces emersonii.
  Eur J Biochem, 271, 4495-4506.
PDB code: 1q9h
15062085 J.Allouch, W.Helbert, B.Henrissat, and M.Czjzek (2004).
Parallel substrate binding sites in a beta-agarase suggest a novel mode of action on double-helical agarose.
  Structure, 12, 623-632.
PDB code: 1urx
15109737 P.I.Kim, and K.C.Chung (2004).
Production of an antifungal protein for control of Colletotrichum lagenarium by Bacillus amyloliquefaciens MET0908.
  FEMS Microbiol Lett, 234, 177-183.  
12867444 J.D.Palumbo, R.F.Sullivan, and D.Y.Kobayashi (2003).
Molecular characterization and expression in Escherichia coli of three beta-1,3-glucanase genes from Lysobacter enzymogenes strain N4-7.
  J Bacteriol, 185, 4362-4370.  
12676681 J.Walter, N.C.Heng, W.P.Hammes, D.M.Loach, G.W.Tannock, and C.Hertel (2003).
Identification of Lactobacillus reuteri genes specifically induced in the mouse gastrointestinal tract.
  Appl Environ Microbiol, 69, 2044-2051.  
12595718 P.Johansson, S.Denman, H.Brumer, A.M.Kallas, H.Henriksson, T.Bergfors, T.T.Teeri, and T.A.Jones (2003).
Crystallization and preliminary X-ray analysis of a xyloglucan endotransglycosylase from Populus tremula x tremuloides.
  Acta Crystallogr D Biol Crystallogr, 59, 535-537.  
11435116 G.Michel, L.Chantalat, E.Duee, T.Barbeyron, B.Henrissat, B.Kloareg, and O.Dideberg (2001).
The kappa-carrageenase of P. carrageenovora features a tunnel-shaped active site: a novel insight in the evolution of Clan-B glycoside hydrolases.
  Structure, 9, 513-525.
PDB code: 1dyp
11526326 L.C.Tsai, L.F.Shyur, S.S.Lin, and H.S.Yuan (2001).
Crystallization and preliminary X-ray diffraction analysis of the 1,3-1,4-beta-D-glucanase from Fibrobacter succinogenes.
  Acta Crystallogr D Biol Crystallogr, 57, 1303-1306.  
11150614 A.Planas (2000).
Bacterial 1,3-1,4-beta-glucanases: structure, function and protein engineering.
  Biochim Biophys Acta, 1543, 361-382.  
10632706 B.O.Petersen, M.Krah, J.O.Duus, and K.K.Thomsen (2000).
A transglycosylating 1,3(4)-beta-glucanase from rhodothermus marinus NMR analysis of enzyme reactions.
  Eur J Biochem, 267, 361-369.  
10587432 K.Piotukh, V.Serra, R.Borriss, and A.Planas (1999).
Protein-carbohydrate interactions defining substrate specificity in Bacillus 1,3-1,4-beta-D-glucan 4-glucanohydrolases as dissected by mutational analysis.
  Biochemistry, 38, 16092-16104.  
9618460 J.Aÿ, F.Götz, R.Borriss, and U.Heinemann (1998).
Structure and function of the Bacillus hybrid enzyme GluXyn-1: native-like jellyroll fold preserved after insertion of autonomous globular domain.
  Proc Natl Acad Sci U S A, 95, 6613-6618.
PDB code: 1axk
9489923 J.Aÿ, M.Hahn, K.Decanniere, K.Piotukh, R.Borriss, and U.Heinemann (1998).
Crystal structures and properties of de novo circularly permuted 1,3-1,4-beta-glucanases.
  Proteins, 30, 155-167.
PDB codes: 1ajk 1ajo
9698381 J.L.Viladot, E.de Ramon, O.Durany, and A.Planas (1998).
Probing the mechanism of Bacillus 1,3-1,4-beta-D-glucan 4-glucanohydrolases by chemical rescue of inactive mutants at catalytically essential residues.
  Biochemistry, 37, 11332-11342.  
9737854 P.E.Johnson, A.L.Creagh, E.Brun, K.Joe, P.Tomme, C.A.Haynes, and L.P.McIntosh (1998).
Calcium binding by the N-terminal cellulose-binding domain from Cellulomonas fimi beta-1,4-glucanase CenC.
  Biochemistry, 37, 12772-12781.  
9345621 B.Henrissat, and G.Davies (1997).
Structural and sequence-based classification of glycoside hydrolases.
  Curr Opin Struct Biol, 7, 637-644.  
9153431 L.F.Mackenzie, G.J.Davies, M.Schülein, and S.G.Withers (1997).
Identification of the catalytic nucleophile of endoglucanase I from Fusarium oxysporum by mass spectrometry.
  Biochemistry, 36, 5893-5901.  
  9251227 N.C.Heng, H.F.Jenkinson, and G.W.Tannock (1997).
Cloning and expression of an endo-1,3-1,4-beta-glucanase gene from Bacillus macerans in Lactobacillus reuteri.
  Appl Environ Microbiol, 63, 3336-3340.  
  8931144 K.Welfle, R.Misselwitz, O.Politz, R.Borriss, and H.Welfle (1996).
Individual amino acids in the N-terminal loop region determine the thermostability and unfolding characteristics of bacterial glucanases.
  Protein Sci, 5, 2255-2265.  
8622963 L.G.Jensen, O.Olsen, O.Kops, N.Wolf, K.K.Thomsen, and D.von Wettstein (1996).
Transgenic barley expressing a protein-engineered, thermostable (1,3-1,4)-beta-glucanase during germination.
  Proc Natl Acad Sci U S A, 93, 3487-3491.  
8916925 P.E.Johnson, M.D.Joshi, P.Tomme, D.G.Kilburn, and L.P.McIntosh (1996).
Structure of the N-terminal cellulose-binding domain of Cellulomonas fimi CenC determined by nuclear magnetic resonance spectroscopy.
  Biochemistry, 35, 14381-14394.
PDB codes: 1ulo 1ulp
8905079 R.A.Warren (1996).
Microbial hydrolysis of polysaccharides.
  Annu Rev Microbiol, 50, 183-212.  
8747464 D.D.Leonidas, B.L.Elbert, Z.Zhou, H.Leffler, S.J.Ackerman, and K.R.Acharya (1995).
Crystal structure of human Charcot-Leyden crystal protein, an eosinophil lysophospholipase, identifies it as a new member of the carbohydrate-binding family of galectins.
  Structure, 3, 1379-1393.
PDB code: 1lcl
7588726 M.Hahn, T.Keitel, and U.Heinemann (1995).
Crystal and molecular structure at 0.16-nm resolution of the hybrid Bacillus endo-1,3-1,4-beta-D-glucan 4-glucanohydrolase H(A16-M).
  Eur J Biochem, 232, 849-858.
PDB code: 2ayh
The most recent references are shown first. Citation data come partly from CiteXplore and partly from an automated harvesting procedure. Note that this is likely to be only a partial list as not all journals are covered by either method. However, we are continually building up the citation data so more and more references will be included with time. Where a reference describes a PDB structure, the PDB codes are shown on the right.

 

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