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7OVW
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BU of 7ovw by Molmil
Binding domain of botulinum neurotoxin E in complex with GD1a
Descriptor: N-acetyl-alpha-neuraminic acid-(2-3)-beta-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-4)-beta-D-galactopyranose, N-acetyl-alpha-neuraminic acid-(2-3)-beta-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-4)-beta-D-galactopyranose-(1-4)-beta-D-glucopyranose, Neurotoxin type E
Authors:Masuyer, G, Stenmark, P.
Deposit date:2021-06-15
Release date:2021-08-11
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Mechanism of Ganglioside Receptor Recognition by Botulinum Neurotoxin Serotype E.
Int J Mol Sci, 22, 2021
2W2D
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BU of 2w2d by Molmil
Crystal Structure of a Catalytically Active, Non-toxic Endopeptidase Derivative of Clostridium botulinum Toxin A
Descriptor: ACETATE ION, BOTULINUM NEUROTOXIN A HEAVY CHAIN, BOTULINUM NEUROTOXIN A LIGHT CHAIN, ...
Authors:Masuyer, G, Thiyagarajan, N, James, P.L, Marks, P.M.H, Chaddock, J.A, Acharya, K.R.
Deposit date:2008-10-29
Release date:2009-03-24
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.59 Å)
Cite:Crystal Structure of a Catalytically Active, Non-Toxic Endopeptidase Derivative of Clostridium Botulinum Toxin A.
Biochem.Biophys.Res.Commun., 381, 2009
6F4E
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BU of 6f4e by Molmil
Crystal structure of the zinc-free catalytic domain of botulinum neurotoxin X
Descriptor: Catalytic domain of botulinum neurotoxin X, DI(HYDROXYETHYL)ETHER
Authors:Masuyer, G, Henriksson, L, Kosenina, S, Zhang, S, Barkho, S, Shen, Y, Dong, M, Stenmark, P.
Deposit date:2017-11-29
Release date:2018-03-14
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structural characterisation of the catalytic domain of botulinum neurotoxin X - high activity and unique substrate specificity.
Sci Rep, 8, 2018
6F47
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BU of 6f47 by Molmil
Crystal structure of the catalytic domain of botulinum neurotoxin X
Descriptor: Catalytic domain of botulinum neurotoxin X, ZINC ION
Authors:Masuyer, G, Henriksson, L, Kosenina, S, Zhang, S, Barkho, S, Shen, Y, Dong, M, Stenmark, P.
Deposit date:2017-11-29
Release date:2018-03-14
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:Structural characterisation of the catalytic domain of botulinum neurotoxin X - high activity and unique substrate specificity.
Sci Rep, 8, 2018
2XHL
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BU of 2xhl by Molmil
Structure of a functional derivative of Clostridium botulinum neurotoxin type B
Descriptor: BOTULINUM NEUROTOXIN B HEAVY CHAIN, BOTULINUM NEUROTOXIN B LIGHT CHAIN, ZINC ION
Authors:Masuyer, G, Beard, M, Cadd, V.A, Chaddock, J.A, Acharya, K.R.
Deposit date:2010-06-18
Release date:2010-12-01
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structure and Activity of a Functional Derivative of Clostridium Botulinum Neurotoxin B.
J.Struct.Biol., 174, 2011
6Z5H
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BU of 6z5h by Molmil
Crystal structure of Aeromonas exotoxin A
Descriptor: ACETATE ION, DI(HYDROXYETHYL)ETHER, Exotoxin, ...
Authors:Masuyer, G.
Deposit date:2020-05-26
Release date:2020-06-24
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal Structure of Exotoxin A from Aeromonas Pathogenic Species.
Toxins, 12, 2020
9G7O
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BU of 9g7o by Molmil
Crystal structure of Janthinobacterium lividum PE-like toxin, Jlx
Descriptor: CHLORIDE ION, DI(HYDROXYETHYL)ETHER, HEXAETHYLENE GLYCOL, ...
Authors:Masuyer, G.
Deposit date:2024-07-22
Release date:2025-01-29
Last modified:2025-03-26
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Discovery of mono-ADP ribosylating toxins with high structural homology to Pseudomonas exotoxin A.
Commun Biol, 8, 2025
9G7P
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BU of 9g7p by Molmil
Crystal structure of Shewanella putrefaciens PE-like toxin, Spx
Descriptor: GLYCEROL, MAGNESIUM ION, Shewanella putrefaciens PE-like toxin catalytically inactive mutant
Authors:Masuyer, G.
Deposit date:2024-07-22
Release date:2025-01-29
Last modified:2025-03-26
Method:X-RAY DIFFRACTION (1.861 Å)
Cite:Discovery of mono-ADP ribosylating toxins with high structural homology to Pseudomonas exotoxin A.
Commun Biol, 8, 2025
9G7M
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BU of 9g7m by Molmil
Crystal structure of Collimonas fungivorans PE-like toxin, Cfx
Descriptor: CALCIUM ION, Exotoxin A-like protein
Authors:Masuyer, G.
Deposit date:2024-07-22
Release date:2025-01-29
Last modified:2025-03-26
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Discovery of mono-ADP ribosylating toxins with high structural homology to Pseudomonas exotoxin A.
Commun Biol, 8, 2025
9G7N
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BU of 9g7n by Molmil
Crystal structure of Chromobacterium haemolyticum PE-like toxin, Hmx
Descriptor: ACETATE ION, Exotoxin A, IMIDAZOLE
Authors:Masuyer, G.
Deposit date:2024-07-22
Release date:2025-01-29
Last modified:2025-03-26
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:Discovery of mono-ADP ribosylating toxins with high structural homology to Pseudomonas exotoxin A.
Commun Biol, 8, 2025
4UFA
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BU of 4ufa by Molmil
Crystal structure of the Angiotensin-1 converting enzyme N-domain in complex with Ac-SD
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ANGIOTENSIN-CONVERTING ENZYME, ...
Authors:Masuyer, G, Douglas, R.G, Sturrock, E.D, Acharya, K.R.
Deposit date:2015-03-16
Release date:2015-10-07
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural Basis of Ac-Sdkp Hydrolysis by Angiotensin-I Converting Enzyme
Sci.Rep., 5, 2015
4UFB
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BU of 4ufb by Molmil
Crystal structure of the Angiotensin-1 converting enzyme N-domain in complex with Lys-Pro
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ANGIOTENSIN-CONVERTING ENZYME, CHLORIDE ION, ...
Authors:Masuyer, G, Douglas, R.G, Sturrock, E.D, Acharya, K.R.
Deposit date:2015-03-16
Release date:2015-10-07
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural Basis of Ac-Sdkp Hydrolysis by Angiotensin-I Converting Enzyme
Sci.Rep., 5, 2015
5N0C
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BU of 5n0c by Molmil
Crystal structure of the tetanus neurotoxin in complex with GM1a
Descriptor: DI(HYDROXYETHYL)ETHER, Tetanus toxin, ZINC ION, ...
Authors:Masuyer, G, Conrad, J, Stenmark, P.
Deposit date:2017-02-02
Release date:2017-06-21
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:The structure of the tetanus toxin reveals pH-mediated domain dynamics.
EMBO Rep., 18, 2017
5N0B
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BU of 5n0b by Molmil
Crystal structure of the tetanus neurotoxin in complex with GD1a
Descriptor: DI(HYDROXYETHYL)ETHER, N-acetyl-alpha-neuraminic acid-(2-3)-beta-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-4)-[N-acetyl-alpha-neuraminic acid-(2-3)]beta-D-galactopyranose-(1-4)-beta-D-glucopyranose, Tetanus toxin, ...
Authors:Masuyer, G, Conrad, J, Stenmark, P.
Deposit date:2017-02-02
Release date:2017-06-21
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:The structure of the tetanus toxin reveals pH-mediated domain dynamics.
EMBO Rep., 18, 2017
5L44
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BU of 5l44 by Molmil
Structure of K-26-DCP in complex with the K-26 tripeptide
Descriptor: K-26 dipeptidyl carboxypeptidase, MAGNESIUM ION, N-ACETYL-L-ILE-L-TYR-(R)-1-AMINO-2-(4-HYDROXYPHENYL)ETHYLPHOSPHONIC ACID, ...
Authors:Masuyer, G, Acharya, K.R, Kramer, G.J, Bachmann, B.O.
Deposit date:2016-05-24
Release date:2016-10-26
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Crystal structure of a peptidyl-dipeptidase K-26-DCP from Actinomycete in complex with its natural inhibitor.
FEBS J., 283, 2016
5L43
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BU of 5l43 by Molmil
Structure of K26-DCP
Descriptor: K-26 dipeptidyl carboxypeptidase, MAGNESIUM ION, SULFATE ION, ...
Authors:Masuyer, G, Acharya, K.R, Kramer, G.J, Bachmann, B.O.
Deposit date:2016-05-24
Release date:2016-10-26
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure of a peptidyl-dipeptidase K-26-DCP from Actinomycete in complex with its natural inhibitor.
FEBS J., 283, 2016
3ZUS
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BU of 3zus by Molmil
Crystal structure of an engineered botulinum neurotoxin type A- SNARE23 derivative, LC-A-SNAP23-Hn-A
Descriptor: BOTULINUM NEUROTOXIN TYPE A, SYNAPTOSOMAL-ASSOCIATED PROTEIN 23, ZINC ION
Authors:Masuyer, G, Stancombe, P, Chaddock, J.A, Acharya, K.R.
Deposit date:2011-07-19
Release date:2011-12-07
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.95 Å)
Cite:Structures of Engineered Clostridium Botulinum Neurotoxin Derivatives
Acta Crystallogr.,Sect.F, 67, 2011
3ZUR
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BU of 3zur by Molmil
Crystal structure of an engineered botulinum neurotoxin type A- SNARE23 derivative, LC0-A-SNAP25-Hn-A
Descriptor: BOTULINUM NEUROTOXIN TYPE A, SYNAPTOSOMAL-ASSOCIATED PROTEIN, SULFATE ION
Authors:Masuyer, G, Stancombe, P, Chaddock, J.A, Acharya, K.R.
Deposit date:2011-07-19
Release date:2011-12-07
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.71 Å)
Cite:Structures of Engineered Clostridium Botulinum Neurotoxin Derivatives
Acta Crystallogr.,Sect.F, 67, 2011
3ZUQ
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BU of 3zuq by Molmil
Crystal structure of an engineered botulinum neurotoxin type B - derivative, LC-B-GS-Hn-B
Descriptor: BOTULINUM NEUROTOXIN TYPE B, ZINC ION
Authors:Masuyer, G, Stancombe, P, Chaddock, J.A, Acharya, K.R.
Deposit date:2011-07-19
Release date:2011-12-07
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Structures of Engineered Clostridium Botulinum Neurotoxin Derivatives
Acta Crystallogr.,Sect.F, 67, 2011
3ZXF
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BU of 3zxf by Molmil
High resolution structure of Human Galectin-7
Descriptor: ACETATE ION, GALECTIN-7
Authors:Masuyer, G, Oberg, C.T, Leffler, H, Nilsson, U.J, Acharya, K.R.
Deposit date:2011-08-10
Release date:2011-11-30
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.38 Å)
Cite:Inhibition Mechanism of Human Galectin-7 by a Novel Galactose-Benzylphosphate Inhibitor.
FEBS J., 279, 2012
3ZXE
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BU of 3zxe by Molmil
Crystal structure of Human Galectin-7 in complex with a galactose- benzylphosphate inhibitor
Descriptor: GALECTIN-7, METHYL 2-O-[(S)-(BENZYLOXY)(HYDROXY)PHOSPHORYL]-3-DEOXY-3-{[(4-METHYLPHENYL)CARBONYL]AMINO}-1-THIO-BETA-D-GALACTOPYRANOSIDE
Authors:Masuyer, G, Oberg, C.T, Leffler, H, Nilsson, U.J, Acharya, K.R.
Deposit date:2011-08-10
Release date:2011-11-30
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.67 Å)
Cite:Inhibition Mechanism of Human Galectin-7 by a Novel Galactose-Benzylphosphate Inhibitor.
FEBS J., 279, 2012
8RVH
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BU of 8rvh by Molmil
Structure of the binding domain of BoNT/A mutant Y1117V/H1253K in complex with the GD1a ganglioside receptor
Descriptor: Botulinum neurotoxin A heavy chain, N-acetyl-alpha-neuraminic acid, beta-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-4)-beta-D-galactopyranose-(1-4)-beta-D-glucopyranose
Authors:Masuyer, G, Stenmark, P.
Deposit date:2024-02-01
Release date:2025-02-12
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Characterisation of botulinum neurotoxin A mutants with enhanced ganglioside binding properties yielding improved potency
To Be Published
8RVI
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BU of 8rvi by Molmil
Structure of the binding domain of BoNT/A mutant H1253K in complex with the GM1a ganglioside receptor
Descriptor: Botulinum neurotoxin A heavy chain, beta-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-4)-[N-acetyl-alpha-neuraminic acid-(2-3)]beta-D-galactopyranose
Authors:Masuyer, G, Stenmark, P.
Deposit date:2024-02-01
Release date:2025-02-12
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Characterisation of botulinum neurotoxin A mutants with enhanced ganglioside binding properties yielding improved potency
To Be Published
8RVG
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BU of 8rvg by Molmil
Structure of the binding domain of BoNT/A mutant Y1117V in complex with the GD1a ganglioside receptor
Descriptor: Botulinum neurotoxin A heavy chain, N-acetyl-alpha-neuraminic acid-(2-3)-beta-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-4)-beta-D-galactopyranose
Authors:Masuyer, G, Stenmark, P.
Deposit date:2024-02-01
Release date:2025-02-12
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Characterisation of botulinum neurotoxin A mutants with enhanced ganglioside binding properties yielding improved potency
To Be Published
5BQN
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BU of 5bqn by Molmil
Crystal structure of the LHn fragment of botulinum neurotoxin type D, mutant H233Y E230Q
Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Botulinum neurotoxin type D,Botulinum neurotoxin type D
Authors:Masuyer, G, Davies, J.R, Moore, K, Chaddock, J.A, Acharya, K.R.
Deposit date:2015-05-29
Release date:2015-08-19
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural analysis of Clostridium botulinum neurotoxin type D as a platform for the development of targeted secretion inhibitors.
Sci Rep, 5, 2015

 

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