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4DE5
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BU of 4de5 by Molmil
Pantothenate synthetase in complex with fragment 6
Descriptor: (2S)-2,3-dihydro-1,4-benzodioxine-2-carboxylic acid, 1,2-ETHANEDIOL, ETHANOL, ...
Authors:Silvestre, H.L.
Deposit date:2012-01-19
Release date:2013-03-06
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Integrated biophysical approach to fragment screening and validation for fragment-based lead discovery.
Proc.Natl.Acad.Sci.USA, 110, 2013
3SGO
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BU of 3sgo by Molmil
Amyloid-related segment of alphaB-crystallin residues 90-100
Descriptor: Alpha-crystallin B chain
Authors:Laganowsky, A, Sawaya, M.R, Cascio, D, Eisenberg, D.
Deposit date:2011-06-15
Release date:2012-03-21
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.557 Å)
Cite:Atomic view of a toxic amyloid small oligomer.
Science, 335, 2012
3SGS
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BU of 3sgs by Molmil
Amyloid-related segment of alphaB-crystallin residues 95-100
Descriptor: Alpha-crystallin B chain
Authors:Laganowsky, A, Sawaya, M.R, Cascio, D, Eisenberg, D.
Deposit date:2011-06-15
Release date:2012-03-21
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.703 Å)
Cite:Atomic view of a toxic amyloid small oligomer.
Science, 335, 2012
4DDM
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BU of 4ddm by Molmil
Pantothenate synthetase in complex with 2,1,3-benzothiadiazole-5-carboxylic acid
Descriptor: 1,2-ETHANEDIOL, 2,1,3-benzothiadiazole-5-carboxylic acid, ETHANOL, ...
Authors:Silvestre, H.L.
Deposit date:2012-01-18
Release date:2013-02-13
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.83 Å)
Cite:Integrated biophysical approach to fragment screening and validation for fragment-based lead discovery.
Proc.Natl.Acad.Sci.USA, 110, 2013
3SGM
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BU of 3sgm by Molmil
Bromoderivative-2 of amyloid-related segment of alphaB-crystallin residues 90-100
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, Alpha-crystallin B chain
Authors:Laganowsky, A, Sawaya, M.R, Cascio, D, Eisenberg, D.
Deposit date:2011-06-15
Release date:2012-03-21
Method:X-RAY DIFFRACTION (1.7006 Å)
Cite:Atomic view of a toxic amyloid small oligomer.
Science, 335, 2012
3SGR
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BU of 3sgr by Molmil
Tandem repeat of amyloid-related segment of alphaB-crystallin residues 90-100 mutant V91L
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, Tandem repeat of amyloid-related segment of alphaB-crystallin residues 90-100 mutant V91L
Authors:Laganowsky, A, Sawaya, M.R, Cascio, D, Eisenberg, D.
Deposit date:2011-06-15
Release date:2012-03-21
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.17 Å)
Cite:Atomic view of a toxic amyloid small oligomer.
Science, 335, 2012
3SGN
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BU of 3sgn by Molmil
Bromoderivative-8 of amyloid-related segment of alphaB-crystallin residues 90-100
Descriptor: Alpha-crystallin B chain
Authors:Laganowsky, A, Sawaya, M.R, Cascio, D, Eisenberg, D.
Deposit date:2011-06-15
Release date:2012-03-21
Method:X-RAY DIFFRACTION (2.807 Å)
Cite:Atomic view of a toxic amyloid small oligomer.
Science, 335, 2012
3SGP
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BU of 3sgp by Molmil
Amyloid-related segment of alphaB-crystallin residues 90-100 mutant V91L
Descriptor: (4R)-2-METHYLPENTANE-2,4-DIOL, (4S)-2-METHYL-2,4-PENTANEDIOL, Alpha-crystallin B chain
Authors:Laganowsky, A, Sawaya, M.R, Cascio, D, Eisenberg, D.
Deposit date:2011-06-15
Release date:2012-03-21
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.4016 Å)
Cite:Atomic view of a toxic amyloid small oligomer.
Science, 335, 2012
1B6F
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BU of 1b6f by Molmil
BIRCH POLLEN ALLERGEN BET V 1
Descriptor: PROTEIN (MAJOR POLLEN ALLERGEN BET V 1-A)
Authors:Schweimer, K, Sticht, H, Boehm, M, Roesch, P.
Deposit date:1999-01-13
Release date:2000-01-17
Last modified:2023-12-27
Method:SOLUTION NMR
Cite:NMR Spectroscopy Reveals Common Structural Features of the Birch Pollen Allergen Bet v 1 and the cherry allergen Pru a 1
APPL.MAGN.RESON., 17, 1999
5I04
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BU of 5i04 by Molmil
Crystal structure of the orphan region of human endoglin/CD105
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Maltose-binding periplasmic protein,Endoglin, TRIETHYLENE GLYCOL, ...
Authors:Saito, T, Bokhove, M, de Sanctis, D, Jovine, L.
Deposit date:2016-02-03
Release date:2017-06-07
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.42 Å)
Cite:Structural Basis of the Human Endoglin-BMP9 Interaction: Insights into BMP Signaling and HHT1.
Cell Rep, 19, 2017
5JFG
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BU of 5jfg by Molmil
Structure of humanised RadA-mutant humRadA22F in complex with peptide FHTA
Descriptor: CALCIUM ION, DIMETHYL SULFOXIDE, DNA repair and recombination protein RadA, ...
Authors:Fischer, G, Marsh, M, Moschetti, T, Sharpe, T, Scott, D, Morgan, M, Ng, H, Skidmore, J, Venkitaraman, A, Abell, C, Blundell, T.L, Hyvonen, M.
Deposit date:2016-04-19
Release date:2016-10-26
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:Humanisation of RadA from Pyrococcus furiosus
To Be Published
5JZD
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BU of 5jzd by Molmil
A re-refinement of the isochorismate synthase EntC
Descriptor: (5S,6S)-5-[(1-carboxyethenyl)oxy]-6-hydroxycyclohexa-1,3-diene-1-carboxylic acid, Isochorismate synthase EntC, MAGNESIUM ION
Authors:Meneely, K.M, Lamb, A.L.
Deposit date:2016-05-16
Release date:2016-07-20
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (2.303 Å)
Cite:An Open and Shut Case: The Interaction of Magnesium with MST Enzymes.
J.Am.Chem.Soc., 138, 2016
4KMB
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BU of 4kmb by Molmil
COMPLEX OF 4'-SULFO-LEWIS-X WITH A SELECTIN-LIKE MUTANT OF MANNOSE-BINDING PROTEIN A
Descriptor: CALCIUM ION, CHLORIDE ION, MANNOSE-BINDING PROTEIN-A, ...
Authors:Ng, K.K.-S, Weis, W.I.
Deposit date:1996-11-07
Release date:1997-02-12
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structure of a selectin-like mutant of mannose-binding protein complexed with sialylated and sulfated Lewis(x) oligosaccharides.
Biochemistry, 36, 1997
5HZW
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BU of 5hzw by Molmil
Crystal structure of the orphan region of human endoglin/CD105 in complex with BMP9
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Growth/differentiation factor 2, Maltose-binding periplasmic protein,Endoglin, ...
Authors:Bokhove, M, Saito, T, Jovine, L.
Deposit date:2016-02-03
Release date:2017-06-07
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (4.451 Å)
Cite:Structural Basis of the Human Endoglin-BMP9 Interaction: Insights into BMP Signaling and HHT1.
Cell Rep, 19, 2017
1KMB
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BU of 1kmb by Molmil
SELECTIN-LIKE MUTANT OF MANNOSE-BINDING PROTEIN A
Descriptor: CALCIUM ION, CHLORIDE ION, MANNOSE-BINDING PROTEIN-A
Authors:Ng, K.K.-S, Weis, W.I.
Deposit date:1996-11-07
Release date:1997-02-12
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structure of a selectin-like mutant of mannose-binding protein complexed with sialylated and sulfated Lewis(x) oligosaccharides.
Biochemistry, 36, 1997
2KMB
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BU of 2kmb by Molmil
COMPLEX OF 3'-NEUAC-LEWIS-X WITH A SELECTIN-LIKE MUTANT OF MANNOSE-BINDING PROTEIN A
Descriptor: CALCIUM ION, CHLORIDE ION, MANNOSE-BINDING PROTEIN-A, ...
Authors:Ng, K.K.-S, Weis, W.I.
Deposit date:1996-11-07
Release date:1997-02-12
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structure of a selectin-like mutant of mannose-binding protein complexed with sialylated and sulfated Lewis(x) oligosaccharides.
Biochemistry, 36, 1997
6HSR
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BU of 6hsr by Molmil
The crystal structure of type II Dehydroquinase from Psychromonas ingrahamii 37, 40% ethanol as cryoprotectant
Descriptor: 3-dehydroquinate dehydratase, ETHANOL, SULFATE ION
Authors:Lapthorn, A.J, Roszak, A.W.
Deposit date:2018-10-01
Release date:2019-10-23
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2 Å)
Cite:The crystal structure of type II Dehydroquinase from Psychromonas ingrahamii 37
To Be Published
6HSB
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BU of 6hsb by Molmil
The crystal structure of type II Dehydroquinase from Acidithiobacillus caldus SM-1
Descriptor: 3-dehydroquinate dehydratase, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, GLYCEROL
Authors:Lapthorn, A.J, Roszak, A.W.
Deposit date:2018-09-29
Release date:2019-10-23
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:The crystal structure of type II Dehydroquinase from Butyrivibrio crossotus DSM 2876
To Be Published
6HSU
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BU of 6hsu by Molmil
The crystal structure of type II Dehydroquinase from Psychromonas ingrahamii 37, crystal form 2
Descriptor: 3-dehydroquinate dehydratase, 3[N-MORPHOLINO]PROPANE SULFONIC ACID, GLYCEROL, ...
Authors:Lapthorn, A.J, Roszak, A.W.
Deposit date:2018-10-01
Release date:2019-10-23
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:The crystal structure of type II Dehydroquinase from Psychromonas ingrahamii 37
To Be Published
6HS9
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BU of 6hs9 by Molmil
The crystal structure of type II Dehydroquinase from Butyrivibrio crossotus DSM 2876
Descriptor: (4S,5R)-4,5-dihydroxy-3-oxocyclohex-1-ene-1-carboxylic acid, 3-dehydroquinate dehydratase
Authors:Lapthorn, A.J, Roszak, A.W.
Deposit date:2018-09-29
Release date:2019-10-23
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:The crystal structure of type II Dehydroquinase from Butyrivibrio crossotus DSM 2876
To Be Published
6HSQ
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BU of 6hsq by Molmil
The crystal structure of type II Dehydroquinase from Psychromonas ingrahamii 37 crystal form 1
Descriptor: 3-dehydroquinate dehydratase, GLYCEROL, SULFATE ION
Authors:Lapthorn, A.J, Roszak, A.W.
Deposit date:2018-10-01
Release date:2019-10-23
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.46 Å)
Cite:The crystal structure of type II Dehydroquinase from Butyrivibrio crossotus DSM 2876
To Be Published
6HSA
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BU of 6hsa by Molmil
The crystal structure of type II Dehydroquinase from Butyrivibrio crossotus DSM 2876
Descriptor: 2-{2-[2-2-(METHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHANOL, 3-dehydroquinate dehydratase, CITRATE ANION, ...
Authors:Lapthorn, A.J, Roszak, A.W.
Deposit date:2018-09-29
Release date:2019-10-23
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:The crystal structure of type II Dehydroquinase from Butyrivibrio crossotus DSM 2876
To Be Published
6HS8
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BU of 6hs8 by Molmil
The crystal structure of type II Dehydroquinase from Butyrivibrio crossotus DSM 2876
Descriptor: 3-dehydroquinate dehydratase, GLYCEROL, L(+)-TARTARIC ACID, ...
Authors:Lapthorn, A.J, Roszak, A.W.
Deposit date:2018-09-29
Release date:2019-10-23
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:The crystal structure of type II Dehydroquinase from Butyrivibrio crossotus DSM 2876
To Be Published
2NAO
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BU of 2nao by Molmil
Atomic resolution structure of a disease-relevant Abeta(1-42) amyloid fibril
Descriptor: Beta-amyloid protein 42
Authors:Waelti, M.A, Ravotti, F, Arai, H, Glabe, C, Wall, J, Bockmann, A, Guntert, P, Meier, B.H, Riek, R.
Deposit date:2016-01-07
Release date:2016-07-27
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Atomic-resolution structure of a disease-relevant A beta (1-42) amyloid fibril.
Proc.Natl.Acad.Sci.USA, 113, 2016
6GZV
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BU of 6gzv by Molmil
Identification of a druggable VP1-VP3 interprotomer pocket in the capsid of enteroviruses
Descriptor: 4-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]sulfonylamino]benzoic acid, Capsid protein VP1, Capsid protein VP2, ...
Authors:Geraets, J.A, Flatt, J.W, Domanska, A, Butcher, S.J.
Deposit date:2018-07-05
Release date:2019-06-05
Last modified:2024-05-15
Method:ELECTRON MICROSCOPY (4 Å)
Cite:A novel druggable interprotomer pocket in the capsid of rhino- and enteroviruses.
Plos Biol., 17, 2019

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数据于2024-10-09公开中

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