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7PA7
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BU of 7pa7 by Molmil
BK polyomavirus VP1 in complex with scFv 29B1
Descriptor: Major capsid protein VP1, scFv 29B1 antibody heavy chain
Authors:Harprecht, C, Stroeh, L.J, Freytag, J, Stehle, T.
Deposit date:2021-07-29
Release date:2023-02-08
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structural characterization of human neutralizing antibodies against JC and BK polyomavirus
To Be Published
2BDF
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BU of 2bdf by Molmil
Src kinase in complex with inhibitor AP23451
Descriptor: Proto-oncogene tyrosine-protein kinase Src, {[(4-{[2-(4-AMINOCYCLOHEXYL)-9-ETHYL-9H-PURIN-6-YL]AMINO}PHENYL)(HYDROXY)PHOSPHORYL]METHYL}PHOSPHONIC ACID
Authors:Dalgarno, D, Stehle, T, Schelling, P, Sawyer, T, Narula, S.
Deposit date:2005-10-20
Release date:2006-10-24
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structural basis of Src tyrosine kinase inhibition with a new class of potent and selective trisubstituted purine-based compounds.
Chem.Biol.Drug Des., 67, 2006
2BDJ
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BU of 2bdj by Molmil
Src kinase in complex with inhibitor AP23464
Descriptor: 3-[2-(2-CYCLOPENTYL-6-{[4-(DIMETHYLPHOSPHORYL)PHENYL]AMINO}-9H-PURIN-9-YL)ETHYL]PHENOL, Proto-oncogene tyrosine-protein kinase Src
Authors:Dalgarno, D, Stehle, T, Schelling, P, Narula, S, Sawyer, T.
Deposit date:2005-10-20
Release date:2006-10-24
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural basis of Src tyrosine kinase inhibition with a new class of potent and selective trisubstituted purine-based compounds.
Chem.Biol.Drug Des., 67, 2006
7QD7
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BU of 7qd7 by Molmil
TarM(Se)_G117R
Descriptor: CHLORIDE ION, GLYCEROL, PENTAETHYLENE GLYCOL, ...
Authors:Guo, Y, Stehle, T.
Deposit date:2021-11-26
Release date:2023-05-10
Last modified:2023-12-06
Method:X-RAY DIFFRACTION (2.06 Å)
Cite:Invasive Staphylococcus epidermidis uses a unique processive wall teichoic acid glycosyltransferase to evade immune recognition.
Sci Adv, 9, 2023
7QH9
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TarM(Se)_G117R-4RboP
Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, TarM(Se)_G117R-4RboP, ...
Authors:Guo, Y, Stehle, T.
Deposit date:2021-12-10
Release date:2023-05-10
Last modified:2023-12-06
Method:X-RAY DIFFRACTION (2.689 Å)
Cite:Invasive Staphylococcus epidermidis uses a unique processive wall teichoic acid glycosyltransferase to evade immune recognition.
Sci Adv, 9, 2023
7QNT
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TarM(Se) native
Descriptor: 1,2-ETHANEDIOL, BETA-MERCAPTOETHANOL, CHLORIDE ION, ...
Authors:Guo, Y, Stehle, T.
Deposit date:2021-12-22
Release date:2023-05-10
Last modified:2023-12-06
Method:X-RAY DIFFRACTION (3.21 Å)
Cite:Invasive Staphylococcus epidermidis uses a unique processive wall teichoic acid glycosyltransferase to evade immune recognition.
Sci Adv, 9, 2023
1IC1
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BU of 1ic1 by Molmil
THE CRYSTAL STRUCTURE FOR THE N-TERMINAL TWO DOMAINS OF ICAM-1
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, INTERCELLULAR ADHESION MOLECULE-1
Authors:Casasnovas, J.M, Stehle, T, Liu, J.-H, Wang, J.-H, Springer, T.A.
Deposit date:1998-03-09
Release date:1998-06-17
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (3 Å)
Cite:A dimeric crystal structure for the N-terminal two domains of intercellular adhesion molecule-1.
Proc.Natl.Acad.Sci.USA, 95, 1998
7B6S
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BU of 7b6s by Molmil
Sheep Polyomavirus VP1 in complex with 10 mM Forssman antigen pentaose
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-alpha-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-3)-alpha-D-galactopyranose-(1-4)-beta-D-galactopyranose, ...
Authors:Rustmeier, N.H, Stehle, T.
Deposit date:2020-12-08
Release date:2022-09-21
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.923 Å)
Cite:A novel and highly specific Forssman antigen-binding protein from sheep polyomavirus
Biorxiv, 2023
7B6U
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Sheep Polyomavirus VP1 in complex with 5 mM Forssman antigen pentaose and 20 mM 6'-sialyllactosamine
Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-alpha-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-3)-alpha-D-galactopyranose-(1-4)-beta-D-galactopyranose, Capsid protein VP1, ...
Authors:Rustmeier, N.H, Stehle, T.
Deposit date:2020-12-08
Release date:2022-09-21
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.901 Å)
Cite:A novel and highly specific Forssman antigen-binding protein from sheep polyomavirus
Biorxiv, 2023
7B6T
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Sheep Polyomavirus VP1 in complex with 10 mM globo-N-tetraose
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-galactopyranose-(1-3)-alpha-D-galactopyranose, ...
Authors:Rustmeier, N.H, Stehle, T.
Deposit date:2020-12-08
Release date:2022-09-21
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.701 Å)
Cite:A novel and highly specific Forssman antigen-binding protein from sheep polyomavirus
Biorxiv, 2023
7B6V
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Sheep Polyomavirus VP1 in complex with 5 mM Forssman antigen pentaose and 20 mM 3'-sialyllactosamine
Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-alpha-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-3)-alpha-D-galactopyranose-(1-4)-beta-D-galactopyranose, 2-acetamido-2-deoxy-alpha-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-3)-alpha-D-galactopyranose-(1-4)-beta-D-galactopyranose-(1-4)-beta-D-glucopyranose, ...
Authors:Rustmeier, N.H, Stehle, T.
Deposit date:2020-12-08
Release date:2022-09-21
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.798 Å)
Cite:A novel and highly specific Forssman antigen-binding protein from sheep polyomavirus
Biorxiv, 2023
1JV2
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BU of 1jv2 by Molmil
CRYSTAL STRUCTURE OF THE EXTRACELLULAR SEGMENT OF INTEGRIN ALPHAVBETA3
Descriptor: 2-acetamido-2-deoxy-alpha-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Xiong, J.P, Stehle, T, Diefenbach, B, Zhang, R, Dunker, R, Scott, D, Joachimiak, A, Goodman, S.L, Arnaout, M.A.
Deposit date:2001-08-28
Release date:2001-10-17
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Crystal structure of the extracellular segment of integrin alpha Vbeta3.
Science, 294, 2001
8BZP
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BU of 8bzp by Molmil
JNK3 (Mitogen-activated protein kinase 10) in Complex with Compound 23 bearing a C(sp3)F2Br moiety
Descriptor: 1,2-ETHANEDIOL, 2-bromanyl-2,2-bis(fluoranyl)-~{N}-(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)ethanamide, BETA-MERCAPTOETHANOL, ...
Authors:Stahlecker, J, Vaas, S, Stehle, T, Boeckler, F.M.
Deposit date:2022-12-15
Release date:2023-08-02
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (1.86 Å)
Cite:Principles and Applications of CF 2 X Moieties as Unconventional Halogen Bond Donors in Medicinal Chemistry, Chemical Biology, and Drug Discovery.
J.Med.Chem., 66, 2023
3EOY
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BU of 3eoy by Molmil
Structure of Reovirus sigma1 in Complex with Its Receptor Junctional Adhesion Molecule-A
Descriptor: Junctional adhesion molecule A, Outer capsid protein sigma-1
Authors:Kirchner, E, Guglielmi, K.M, Dermody, T.S, Stehle, T.
Deposit date:2008-09-29
Release date:2008-11-04
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (3.4 Å)
Cite:Structure of reovirus sigma1 in complex with its receptor junctional adhesion molecule-A
Plos Pathog., 4, 2008
3EXW
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BU of 3exw by Molmil
Crystal structure of the human Adenovirus type 7 fiber knob
Descriptor: L5 fiber protein
Authors:Persson, B.D, Reiter, D.M, Arnberg, N, Stehle, T.
Deposit date:2008-10-17
Release date:2008-11-25
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:An arginine switch in the species B adenovirus knob determines high-affinity engagement of cellular receptor CD46
J.Virol., 83, 2009
3I4Z
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BU of 3i4z by Molmil
Crystal structure of the dimethylallyl tryptophan synthase FgaPT2 from Aspergillus fumigatus
Descriptor: 1,3-BUTANEDIOL, GLYCEROL, Tryptophan dimethylallyltransferase
Authors:Schall, C, Zocher, G, Stehle, T.
Deposit date:2009-07-03
Release date:2009-09-01
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:The structure of dimethylallyl tryptophan synthase reveals a common architecture of aromatic prenyltransferases in fungi and bacteria
Proc.Natl.Acad.Sci.USA, 106, 2009
3INB
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BU of 3inb by Molmil
Structure of the measles virus hemagglutinin bound to the CD46 receptor
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Hemagglutinin glycoprotein, Membrane cofactor protein, ...
Authors:Santiago, C, Celma, M.L, Stehle, T, Casasnovas, J.M.
Deposit date:2009-08-12
Release date:2009-12-22
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Structure of the measles virus hemagglutinin bound to the CD46 receptor
Nat.Struct.Mol.Biol., 17, 2010
3I4X
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BU of 3i4x by Molmil
Crystal structure of the dimethylallyl tryptophan synthase FgaPT2 from Aspergillus fumigatus in complex with Trp and DMSPP
Descriptor: DIMETHYLALLYL S-THIOLODIPHOSPHATE, GLYCEROL, TRYPTOPHAN, ...
Authors:Schall, C, Zocher, G, Stehle, T.
Deposit date:2009-07-03
Release date:2009-09-01
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:The structure of dimethylallyl tryptophan synthase reveals a common architecture of aromatic prenyltransferases in fungi and bacteria
Proc.Natl.Acad.Sci.USA, 106, 2009
3BWQ
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BU of 3bwq by Molmil
Structure of free SV40 VP1 pentamer
Descriptor: Capsid protein VP1
Authors:Neu, U, Stehle, T.
Deposit date:2008-01-10
Release date:2008-03-04
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural basis of GM1 ganglioside recognition by simian virus 40.
Proc.Natl.Acad.Sci.Usa, 105, 2008
3BWR
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BU of 3bwr by Molmil
SV40 VP1 pentamer in complex with GM1 oligosaccharide
Descriptor: 1,2-ETHANEDIOL, Capsid protein VP1, 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
Authors:Neu, U, Stehle, T.
Deposit date:2008-01-10
Release date:2008-03-04
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Structural basis of GM1 ganglioside recognition by simian virus 40.
Proc.Natl.Acad.Sci.Usa, 105, 2008
6GAO
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BU of 6gao by Molmil
Crystal structure of the T1L reovirus sigma1 coiled coil tail and body
Descriptor: CHLORIDE ION, Outer capsid protein sigma-1
Authors:Dietrich, M.H, Stehle, T.
Deposit date:2018-04-11
Release date:2018-04-25
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.101 Å)
Cite:Structural and Functional Features of the Reovirus sigma 1 Tail.
J. Virol., 92, 2018
7PA8
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BU of 7pa8 by Molmil
JC polyomavirus VP1 in complex with Fab 27C2
Descriptor: Fab 27C2 heavy chain, Fab 27C2 light chain, Major capsid protein VP1
Authors:Stroeh, L.J, Harprecht, C, Freytag, J, Stehle, T.
Deposit date:2021-07-29
Release date:2023-02-08
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (3.15 Å)
Cite:Structural characterization of human neutralizing antibodies against JC and BK polyomavirus
To Be Published
7PA6
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JC polyomavirus VP1 in complex with scFv 27C11
Descriptor: Major capsid protein VP1, scFv 27C11 antibody heavy chain
Authors:Harprecht, C, Stroeh, L.J, Nagel, F, Freytag, J, Stehle, T.
Deposit date:2021-07-29
Release date:2023-02-08
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structural characterization of human neutralizing antibodies against JC and BK polyomavirus
To Be Published
7PA9
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JC polyomavirus VP1 in complex with Fab 98D3
Descriptor: Fab 98D3 VH, Fab 98D3 VL, Major capsid protein VP1
Authors:Stroeh, L.J, Harprecht, C, Freytag, J, Stehle, T.
Deposit date:2021-07-29
Release date:2023-02-08
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.75 Å)
Cite:Structural characterization of human neutralizing antibodies against JC and BK polyomavirus
To Be Published
7ZIP
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BU of 7zip by Molmil
JC Polyomavirus VP1 in complex with 3'-Sialyllactose glycomacromolecules (aliphatic linker)
Descriptor: Major capsid protein VP1, N-acetyl-alpha-neuraminic acid-(2-3)-beta-D-galactopyranose-(1-4)-beta-D-glucopyranose
Authors:Freytag, J, Mueller, J.C, Stehle, T.
Deposit date:2022-04-08
Release date:2022-12-21
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Synthesis of Homo- and Heteromultivalent Fucosylated and Sialylated Oligosaccharide Conjugates via Preactivated N -Methyloxyamine Precision Macromolecules and Their Binding to Polyomavirus Capsid Proteins.
Biomacromolecules, 23, 2022

221716

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