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5IVN
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BU of 5ivn by Molmil
BC2 nanobody in complex with the BC2 peptide tag
Descriptor: BC2-nanobody, Cadherin derived peptide
Authors:Braun, M.B, Stehle, T.
Deposit date:2016-03-21
Release date:2016-04-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1 Å)
Cite:Peptides in headlock - a novel high-affinity and versatile peptide-binding nanobody for proteomics and microscopy.
Sci Rep, 6, 2016
4Y7U
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BU of 4y7u by Molmil
Structural analysis of MurU
Descriptor: 2-acetamido-3-O-[(1R)-1-carboxyethyl]-2-deoxy-1-O-phosphono-alpha-D-glucopyranose, 5'-O-[(S)-hydroxy{[(S)-hydroxy(phosphonooxy)phosphoryl]amino}phosphoryl]uridine, GLYCEROL, ...
Authors:Renner-Schneck, M.G, Stehle, T.
Deposit date:2015-02-16
Release date:2015-03-18
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Crystal Structure of the N-Acetylmuramic Acid alpha-1-Phosphate (MurNAc-alpha 1-P) Uridylyltransferase MurU, a Minimal Sugar Nucleotidyltransferase and Potential Drug Target Enzyme in Gram-negative Pathogens.
J.Biol.Chem., 290, 2015
4Y7V
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BU of 4y7v by Molmil
Structural analysis of MurU
Descriptor: 2-acetamido-3-O-[(1R)-1-carboxyethyl]-2-deoxy-1-O-phosphono-alpha-D-glucopyranose, GLYCEROL, IMIDODIPHOSPHORIC ACID, ...
Authors:Renner-Schneck, M.G, Stehle, T.
Deposit date:2015-02-16
Release date:2015-03-18
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal Structure of the N-Acetylmuramic Acid alpha-1-Phosphate (MurNAc-alpha 1-P) Uridylyltransferase MurU, a Minimal Sugar Nucleotidyltransferase and Potential Drug Target Enzyme in Gram-negative Pathogens.
J.Biol.Chem., 290, 2015
6GS2
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BU of 6gs2 by Molmil
Crystal Structure of the GatD/MurT Enzyme Complex from Staphylococcus aureus
Descriptor: DI(HYDROXYETHYL)ETHER, MAGNESIUM ION, SA1707 protein, ...
Authors:Muckenfuss, L.M, Noeldeke, E.R, Niemann, V, Zocher, G, Stehle, T.
Deposit date:2018-06-13
Release date:2018-09-05
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (2.04 Å)
Cite:Structural basis of cell wall peptidoglycan amidation by the GatD/MurT complex of Staphylococcus aureus.
Sci Rep, 8, 2018
6H5E
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BU of 6h5e by Molmil
Crystal Structure of the GatD/MurT Enzyme Complex from Staphylococcus aureus with bound AMPPNP
Descriptor: DI(HYDROXYETHYL)ETHER, DUF1727 domain-containing protein, GLYCEROL, ...
Authors:Noeldeke, E.R, Niemann, V, Stoerk, E, Stehle, T.
Deposit date:2018-07-24
Release date:2018-09-05
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.139 Å)
Cite:Structural basis of cell wall peptidoglycan amidation by the GatD/MurT complex of Staphylococcus aureus.
Sci Rep, 8, 2018
6G47
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BU of 6g47 by Molmil
Crystal Structure of Human Adenovirus 52 Short Fiber Knob in Complex with alpha-(2,8)-Trisialic Acid (DP3)
Descriptor: (4R)-2-METHYLPENTANE-2,4-DIOL, (4S)-2-METHYL-2,4-PENTANEDIOL, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, ...
Authors:Liaci, A.M, Stehle, T.
Deposit date:2018-03-26
Release date:2018-05-02
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.497 Å)
Cite:Polysialic acid is a cellular receptor for human adenovirus 52.
Proc. Natl. Acad. Sci. U.S.A., 115, 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
7PAA
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BU of 7paa by Molmil
JC polyomavirus VP1 in complex with scFv 29B1
Descriptor: Major capsid protein VP1, scFv 29B1
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 (3.102 Å)
Cite:Structural characterization of human neutralizing antibodies against JC and BK polyomavirus
To Be Published
7PA6
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BU of 7pa6 by Molmil
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
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
7PA9
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BU of 7pa9 by Molmil
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
8A92
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BU of 8a92 by Molmil
p53-Y220C Core Domain in Complex with a Bromo-trifluoro-pyrazole-amine
Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, 4-bromanyl-5-(trifluoromethyl)-1H-pyrazol-3-amine, Cellular tumor antigen p53, ...
Authors:Stahlecker, J, Braun, M.B, Stehle, T, Boeckler, F.M.
Deposit date:2022-06-27
Release date:2022-11-09
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.37 Å)
Cite:Revisiting a challenging p53 binding site: a diversity-optimized HEFLib reveals diverse binding modes in T-p53C-Y220C.
Rsc Med Chem, 13, 2022
3MOR
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BU of 3mor by Molmil
Crystal structure of Cathepsin B from Trypanosoma Brucei
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, Cathepsin B-like cysteine protease, ...
Authors:Cupelli, K, Stehle, T.
Deposit date:2010-04-23
Release date:2011-11-02
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:In vivo protein crystallization opens new routes in structural biology.
Nat.Methods, 9, 2012
3S3L
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BU of 3s3l by Molmil
Crystal Structure of CerJ from Streptomyces tendae
Descriptor: ACETATE ION, CHLORIDE ION, CerJ
Authors:Zocher, G, Hertweck, C, Bretschneider, T, Stehle, T.
Deposit date:2011-05-18
Release date:2011-12-21
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2 Å)
Cite:A ketosynthase homolog uses malonyl units to form esters in cervimycin biosynthesis.
Nat.Chem.Biol., 8, 2011
7QB5
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BU of 7qb5 by Molmil
Coxsackievirus A24v (CVA24v) in complex with a dimeric C2-C9-linked sialic acid inhibitor
Descriptor: CALCIUM ION, CHLORIDE ION, Capsid protein VP1, ...
Authors:Zocher, G, Stehle, T.
Deposit date:2021-11-18
Release date:2022-05-18
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.728 Å)
Cite:Exploring divalent conjugates of 5- N -acetyl-neuraminic acid as inhibitors of coxsackievirus A24 variant (CVA24v) transduction.
Rsc Adv, 12, 2022
7ZH8
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BU of 7zh8 by Molmil
DYRK1a in Complex with a Bromo-Triazolo-Pyridine
Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, 6-bromanyl-3H-[1,2,3]triazolo[4,5-b]pyridine, CHLORIDE ION, ...
Authors:Dammann, M, Stahlecker, J, Stehle, T, Boeckler, F.M.
Deposit date:2022-04-05
Release date:2022-11-09
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Screening of a Halogen-Enriched Fragment Library Leads to Unconventional Binding Modes.
J.Med.Chem., 65, 2022
3T6S
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BU of 3t6s by Molmil
Crystal structure of CerJ from Streptomyces tendae in Complex with CoA
Descriptor: COENZYME A, CerJ
Authors:Zocher, G, Bretschneider, T, Hertweck, C, Stehle, T.
Deposit date:2011-07-29
Release date:2011-12-21
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (2 Å)
Cite:A ketosynthase homolog uses malonyl units to form esters in cervimycin biosynthesis.
Nat.Chem.Biol., 8, 2011
3NXG
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BU of 3nxg by Molmil
JC polyomavirus VP1
Descriptor: 1,2-ETHANEDIOL, GLYCEROL, Major capsid protein VP1
Authors:Neu, U, Stroeh, L.J, Stehle, T.
Deposit date:2010-07-13
Release date:2010-11-17
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Structure-function analysis of the human JC polyomavirus establishes the LSTc pentasaccharide as a functional receptor motif.
Cell Host Microbe, 8, 2010
3NXD
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BU of 3nxd by Molmil
JC polyomavirus VP1 in complex with LSTc
Descriptor: 1,2-ETHANEDIOL, GLYCEROL, Major capsid protein VP1, ...
Authors:Neu, U, Stroeh, L.J, Stehle, T.
Deposit date:2010-07-13
Release date:2010-11-17
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structure-function analysis of the human JC polyomavirus establishes the LSTc pentasaccharide as a functional receptor motif.
Cell Host Microbe, 8, 2010
3T5Y
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BU of 3t5y by Molmil
Crystal structure of CerJ from Streptomyces tendae - malonic acid covalently linked to the catalytic Cystein C116
Descriptor: ACETATE ION, CerJ
Authors:Zocher, G, Bretschneider, T, Hertweck, C, Stehle, T.
Deposit date:2011-07-28
Release date:2011-12-21
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (2.12 Å)
Cite:A ketosynthase homolog uses malonyl units to form esters in cervimycin biosynthesis.
Nat.Chem.Biol., 8, 2011
3T8E
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BU of 3t8e by Molmil
Crystal structure of CerJ from Streptomyces tendae soaked with CerviK
Descriptor: ACETATE ION, CerJ
Authors:Zocher, G, Bretschneider, T, Hertweck, C, Stehle, T.
Deposit date:2011-08-01
Release date:2011-12-21
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:A ketosynthase homolog uses malonyl units to form esters in cervimycin biosynthesis.
Nat.Chem.Biol., 8, 2011
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
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
4MBY
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BU of 4mby by Molmil
Structure of B-Lymphotropic Polyomavirus VP1 in complex with 3'-sialyllactose
Descriptor: 1,2-ETHANEDIOL, CALCIUM ION, CHLORIDE ION, ...
Authors:Khan, Z.M, Neu, U, Stehle, T.
Deposit date:2013-08-21
Release date:2013-12-04
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.48 Å)
Cite:Structures of B-Lymphotropic Polyomavirus VP1 in Complex with Oligosaccharide Ligands.
Plos Pathog., 9, 2013
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

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