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4QDM
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BU of 4qdm by Molmil
Crystal structure of N-terminal mutant (V1L) of an alkali thermostable GH10 xylanase from Bacillus sp. NG-27
Descriptor: Alkaline thermostable endoxylanase, GLYCEROL, MAGNESIUM ION, ...
Authors:Mahanta, P, Bhardwaj, A, Reddy, V.S, Ramakumar, S.
Deposit date:2014-05-14
Release date:2015-05-20
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.964 Å)
Cite:Structural insights into N-terminal to C-terminal interactions and implications for thermostability of a (beta/alpha)8-triosephosphate isomerase barrel enzyme
Febs J., 282, 2015
4QCE
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BU of 4qce by Molmil
Crystal structure of recombinant alkali thermostable GH10 xylanase from Bacillus sp. NG-27
Descriptor: Alkaline thermostable endoxylanase, MAGNESIUM ION, SODIUM ION
Authors:Mahanta, P, Bhardwaj, A, Reddy, V.S, Ramakumar, S.
Deposit date:2014-05-11
Release date:2015-05-20
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.32 Å)
Cite:Structural insights into N-terminal to C-terminal interactions and implications for thermostability of a (beta/alpha)8-triosephosphate isomerase barrel enzyme
Febs J., 282, 2015
4QCF
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BU of 4qcf by Molmil
Crystal structure of N-terminal mutant (V1A) of an alkali thermostable GH10 xylanase from Bacillus sp. NG-27
Descriptor: Alkaline thermostable endoxylanase, CHLORIDE ION, MAGNESIUM ION, ...
Authors:Mahanta, P, Bhardwaj, A, Reddy, V.S, Ramakumar, S.
Deposit date:2014-05-11
Release date:2015-05-20
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.26 Å)
Cite:Structural insights into N-terminal to C-terminal interactions and implications for thermostability of a (beta/alpha)8-triosephosphate isomerase barrel enzyme
Febs J., 282, 2015
4QPW
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BU of 4qpw by Molmil
BiXyn10A CBM1 with Xylohexaose Bound
Descriptor: beta-D-xylopyranose-(1-4)-beta-D-xylopyranose-(1-4)-beta-D-xylopyranose, glycosyl hydrolase family 10
Authors:Chekan, J.R, Nair, S.K.
Deposit date:2014-06-25
Release date:2014-08-13
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.14 Å)
Cite:Xylan utilization in human gut commensal bacteria is orchestrated by unique modular organization of polysaccharide-degrading enzymes.
Proc.Natl.Acad.Sci.USA, 111, 2014
5OFL
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BU of 5ofl by Molmil
Crystal structure of CbXyn10C variant E140Q/E248Q complexed with cellohexaose
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, Glycoside hydrolase family 48, SULFATE ION, ...
Authors:Hakulinen, N, Penttinen, L, Rouvinen, J.
Deposit date:2017-07-11
Release date:2017-10-04
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.871 Å)
Cite:Insights into the roles of non-catalytic residues in the active site of a GH10 xylanase with activity on cellulose.
J. Biol. Chem., 292, 2017
5OFK
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BU of 5ofk by Molmil
Crystal structure of CbXyn10C variant E140Q/E248Q complexed with xyloheptaose
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, Glycoside hydrolase family 48, PIPERAZINE-N,N'-BIS(2-ETHANESULFONIC ACID), ...
Authors:Hakulinen, N, Penttinen, L, Rouvinen, J, Tu, T.
Deposit date:2017-07-11
Release date:2017-10-04
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.16 Å)
Cite:Insights into the roles of non-catalytic residues in the active site of a GH10 xylanase with activity on cellulose.
J. Biol. Chem., 292, 2017
5OFJ
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BU of 5ofj by Molmil
Crystal structure of N-terminal domain of bifunctional CbXyn10C
Descriptor: 1,2-ETHANEDIOL, CITRATE ANION, Glycoside hydrolase family 48
Authors:Hakulinen, N, Penttinen, L, Rouvinen, J.
Deposit date:2017-07-11
Release date:2017-10-04
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.34 Å)
Cite:Insights into the roles of non-catalytic residues in the active site of a GH10 xylanase with activity on cellulose.
J. Biol. Chem., 292, 2017
5RG8
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BU of 5rg8 by Molmil
Crystal Structure of Kemp Eliminase HG3.17 in unbound state, 277K
Descriptor: ACETATE ION, Kemp Eliminase HG3
Authors:Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A.
Deposit date:2020-03-19
Release date:2020-07-22
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.73 Å)
Cite:Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico.
Nat Commun, 11, 2020
5RG5
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BU of 5rg5 by Molmil
Crystal Structure of Kemp Eliminase HG3.3b in unbound state, 277K
Descriptor: ACETATE ION, Kemp Eliminase HG3, SULFATE ION
Authors:Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A.
Deposit date:2020-03-19
Release date:2020-07-22
Last modified:2021-05-12
Method:X-RAY DIFFRACTION (1.62 Å)
Cite:Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico.
Nat Commun, 11, 2020
5RG6
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BU of 5rg6 by Molmil
Crystal Structure of Kemp Eliminase HG3.7 in unbound state, 277K
Descriptor: Kemp Eliminase HG3, SULFATE ION
Authors:Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A.
Deposit date:2020-03-19
Release date:2020-07-22
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico.
Nat Commun, 11, 2020
5RGB
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BU of 5rgb by Molmil
Crystal Structure of Kemp Eliminase HG3.3b with bound transition state analogue, 277K
Descriptor: 6-NITROBENZOTRIAZOLE, Kemp Eliminase HG3.3b, SULFATE ION
Authors:Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A.
Deposit date:2020-03-19
Release date:2020-07-22
Last modified:2021-05-12
Method:X-RAY DIFFRACTION (1.42 Å)
Cite:Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico.
Nat Commun, 11, 2020
5RGD
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BU of 5rgd by Molmil
Crystal Structure of Kemp Eliminase HG3.14 with bound transition state analogue, 277K
Descriptor: 6-NITROBENZOTRIAZOLE, Kemp Eliminase HG3.14, SULFATE ION
Authors:Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A.
Deposit date:2020-03-19
Release date:2020-07-22
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico.
Nat Commun, 11, 2020
5RG4
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BU of 5rg4 by Molmil
Crystal Structure of Kemp Eliminase HG3 in unbound state, 277K
Descriptor: ACETATE ION, Kemp Eliminase HG3, SULFATE ION
Authors:Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A.
Deposit date:2020-03-19
Release date:2020-07-22
Last modified:2021-05-12
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico.
Nat Commun, 11, 2020
3MMD
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BU of 3mmd by Molmil
Crystal structure of the W241A mutant of xylanase from Geobacillus stearothermophilus T-6 (XT6) complexed with hydrolyzed xylopentaose
Descriptor: CHLORIDE ION, Endo-1,4-beta-xylanase, SODIUM ION, ...
Authors:Solomon, V, Zolotnitsky, G, Feinberg, H, Tabachnikov, O, Shoham, Y, Shoham, G.
Deposit date:2010-04-19
Release date:2011-04-27
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural-based rational mutagenesis of xylanases from G.stearothermophilus
TO BE PUBLISHED
3MSG
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BU of 3msg by Molmil
Enzyme-Substrate interactions of IXT6, the intracellular xylanase of G. stearothermophilus.
Descriptor: ACETATE ION, GLYCEROL, Intra-cellular xylanase ixt6, ...
Authors:Solomon, V, Zolotnitsky, G, Alhadeff, R, Shoham, Y, Shoham, G.
Deposit date:2010-04-29
Release date:2011-05-11
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Enzyme-Substrate interactions of IXT6, the intracellular xylanase of G. stearothermophilus.
TO BE PUBLISHED
3MS8
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BU of 3ms8 by Molmil
Enzyme-Substrate interactions of IXT6, the intracellular xylanase of G. stearothermophilus.
Descriptor: GLYCEROL, Intra-cellular xylanase ixt6, SODIUM ION
Authors:Solomon, V, Zolotnitsky, G, Alhadeff, R, Shoham, Y, Shoham, G.
Deposit date:2010-04-29
Release date:2011-05-11
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Enzyme-Substrate interactions of IXT6, the intracellular xylanase of G. stearothermophilus.
TO BE PUBLISHED
3MSD
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BU of 3msd by Molmil
Enzyme-Substrate interactions of IXT6, the intracellular xylanase of G. stearothermophilus.
Descriptor: ACETATE ION, GLYCEROL, Intra-cellular xylanase ixt6, ...
Authors:Solomon, V, Zolotnitsky, G, Alhadeff, R, Shoham, Y, Shoham, G.
Deposit date:2010-04-29
Release date:2011-05-11
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.58 Å)
Cite:Enzyme-Substrate interactions of IXT6, the intracellular xylanase of G. stearothermophilus.
TO BE PUBLISHED
3MUA
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BU of 3mua by Molmil
Enzyme-Substrate interactions of IXT6, the intracellular xylanase of G. stearothermophilus.
Descriptor: ACETATE ION, GLYCEROL, SODIUM ION, ...
Authors:Solomon, V, Zolotnitsky, G, Alhadeff, R, Shoham, Y, Shoham, G.
Deposit date:2010-05-02
Release date:2011-06-01
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Enzyme-Substrate interactions of IXT6, the intracellular xylanase of G. stearothermophilus.
TO BE PUBLISHED
3MUI
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BU of 3mui by Molmil
Enzyme-Substrate interactions of IXT6, the intracellular xylanase of G. stearothermophilus.
Descriptor: GLYCEROL, SODIUM ION, Xylanase, ...
Authors:Solomon, V, Zolotnitsky, G, Alhadeff, R, Shoham, Y, Shoham, G.
Deposit date:2010-05-03
Release date:2011-06-01
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Enzyme-Substrate interactions of IXT6, the intracellular xylanase of G. stearothermophilus.
To be Published
3NIY
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BU of 3niy by Molmil
Crystal structure of native xylanase 10B from Thermotoga petrophila RKU-1
Descriptor: ACETATE ION, Endo-1,4-beta-xylanase, SULFATE ION
Authors:Santos, C.R, Meza, A.N, Trindade, D.M, Ruller, R, Squina, F.M, Prade, R.A, Murakami, M.T.
Deposit date:2010-06-16
Release date:2011-05-04
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.58 Å)
Cite:Thermal-induced conformational changes in the product release area drive the enzymatic activity of xylanases 10B: Crystal structure, conformational stability and functional characterization of the xylanase 10B from Thermotoga petrophila RKU-1.
Biochem.Biophys.Res.Commun., 403, 2010
3NJ3
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BU of 3nj3 by Molmil
Crystal structure of xylanase 10B from Thermotoga petrophila RKU-1 in complex with xylobiose
Descriptor: ACETATE ION, Endo-1,4-beta-xylanase, SULFATE ION, ...
Authors:Santos, C.R, Meza, A.N, Trindade, D.M, Ruller, R, Squina, F.M, Prade, R.A, Murakami, M.T.
Deposit date:2010-06-16
Release date:2011-05-04
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:Thermal-induced conformational changes in the product release area drive the enzymatic activity of xylanases 10B: Crystal structure, conformational stability and functional characterization of the xylanase 10B from Thermotoga petrophila RKU-1.
Biochem.Biophys.Res.Commun., 403, 2010
3O2L
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BU of 3o2l by Molmil
Crystal Structure of an Inactive Kemp Elimination Design HG-1
Descriptor: Endo-1,4-beta-xylanase
Authors:Thomas, L.M, Privett, H.K, Mayo, S.L.
Deposit date:2010-07-22
Release date:2011-07-20
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2 Å)
Cite:Iterative approach to computational enzyme design.
Proc.Natl.Acad.Sci.USA, 109, 2012
3NYD
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BU of 3nyd by Molmil
Crystal Structure of Kemp Eliminase HG-2 Complexed with Transition State Analog 5-Nitro Benzotriazole
Descriptor: 5-nitro-1H-benzotriazole, ACETATE ION, Endo-1,4-beta-xylanase, ...
Authors:Lee, T.M, Privett, H.K, Kaiser, J.T, Mayo, S.L.
Deposit date:2010-07-14
Release date:2011-06-29
Last modified:2012-04-25
Method:X-RAY DIFFRACTION (1.23 Å)
Cite:Iterative approach to computational enzyme design.
Proc.Natl.Acad.Sci.USA, 109, 2012
7K4Y
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BU of 7k4y by Molmil
Crystal structure of Kemp Eliminase HG3.17 at 343 K
Descriptor: Endo-1,4-beta-xylanase
Authors:Padua, R.A.P, Otten, R, Bunzel, A, Nguyen, V, Pitsawong, W, Patterson, M, Sui, S, Perry, S.L, Cohen, A.E, Hilvert, D, Kern, D.
Deposit date:2020-09-16
Release date:2020-12-02
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:How directed evolution reshapes the energy landscape in an enzyme to boost catalysis.
Science, 370, 2020
7K4Q
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BU of 7k4q by Molmil
Crystal structure of Kemp Eliminase HG3 in complex with the transition state analog 6-nitrobenzotriazole
Descriptor: 6-NITROBENZOTRIAZOLE, Endo-1,4-beta-xylanase, SULFATE ION
Authors:Padua, R.A.P, Otten, R, Bunzel, A, Nguyen, V, Pitsawong, W, Patterson, M, Sui, S, Perry, S.L, Cohen, A.E, Hilvert, D, Kern, D.
Deposit date:2020-09-16
Release date:2020-12-02
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.28 Å)
Cite:How directed evolution reshapes the energy landscape in an enzyme to boost catalysis.
Science, 370, 2020

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