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6ENI
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BU of 6eni by Molmil
Tryptophan Repressor TrpR from E.coli variant T44L S88Y with Indole-3-acetic acid as ligand
Descriptor: 1,2-ETHANEDIOL, 1H-INDOL-3-YLACETIC ACID, Trp operon repressor
Authors:Stiel, A.C, Shanmugaratnam, S, Herud-Sikimic, O, Juergens, G, Hocker, B.
Deposit date:2017-10-04
Release date:2019-02-06
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:A biosensor for the direct visualization of auxin
Nature, 2021
6ELG
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BU of 6elg by Molmil
Tryptophan Repressor TrpR from E.coli variant M42F T44L T81I S88Y with Indole-3-acetonitrile
Descriptor: 1H-indol-3-ylacetonitrile, Trp operon repressor
Authors:Stiel, A.C, Shanmugaratnam, S, Herud-Sikimic, O, Juergens, G, Hocker, B.
Deposit date:2017-09-28
Release date:2019-02-06
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.38 Å)
Cite:A biosensor for the direct visualization of auxin
Nature, 2021
6SLD
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BU of 6sld by Molmil
Structure of the Phosphatidylcholine Binding Mutant of Yeast Sec14 Homolog Sfh1 (S175I,T177I) in Complex with Phosphatidylinositol
Descriptor: (1R)-2-{[(S)-hydroxy{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}phosphoryl]oxy}-1-[(octadecanoyloxy)methyl]ethyl (9Z)-octadec-9-enoate, CRAL-TRIO domain-containing protein YKL091C
Authors:Berger, J, Fitz, M, Johnen, P, Shanmugaratnam, S, Hocker, B, Stiel, A.C, Schaaf, G.
Deposit date:2019-08-19
Release date:2020-08-19
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Structure of the Phosphatidylcholine Binding Mutant of Yeast Sec14 Homolog Sfh1 (S175I,T177I) in Complex with Phosphatidylinositol
To Be Published
8AT0
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BU of 8at0 by Molmil
PotF with mutation D247K
Descriptor: (2R)-1-methoxypropan-2-amine, (2~{S})-1-(2-methoxyethoxy)propan-2-amine, 1,2-ETHANEDIOL, ...
Authors:Kroeger, P, Shanmugaratnam, S, Hocker, B.
Deposit date:2022-08-22
Release date:2024-03-06
Method:X-RAY DIFFRACTION (2 Å)
Cite:A fluorescent biosensor for the visualization of Agmatine
To Be Published
8ASZ
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BU of 8asz by Molmil
PotF with mutations S87Y and A182D in complex with Agmatine
Descriptor: 1,2-ETHANEDIOL, AGMATINE, CALCIUM ION, ...
Authors:Kroeger, P, Shanmugaratnam, S, Hocker, B.
Deposit date:2022-08-22
Release date:2024-03-06
Method:X-RAY DIFFRACTION (1.28 Å)
Cite:A fluorescent biosensor for the visualization of Agmatine
To Be Published
8R8N
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BU of 8r8n by Molmil
Hallucinated de novo TIM barrel with two helical extensions - HalluTIM2-2
Descriptor: HalluTIM2-2, SULFATE ION
Authors:Beck, J, Shanmugaratnam, S, Hocker, B.
Deposit date:2023-11-29
Release date:2024-05-22
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:Diversifying de novo TIM barrels by hallucination.
Protein Sci., 33, 2024
8R8O
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BU of 8r8o by Molmil
Hallucinated de novo TIM barrel with three helical extensions - HalluTIM3-1
Descriptor: ACETATE ION, CHLORIDE ION, GLYCEROL, ...
Authors:Beck, J, Shanmugaratnam, S, Hocker, B.
Deposit date:2023-11-29
Release date:2024-05-22
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Diversifying de novo TIM barrels by hallucination.
Protein Sci., 33, 2024
6YQY
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BU of 6yqy by Molmil
Crystal structure of sTIM11noCys, a de novo designed TIM barrel
Descriptor: de novo designed TIM barrel sTIM11noCys
Authors:Romero-Romero, S, Wiese, G.J, Kordes, S, Shanmugaratnam, S, Fernandez-Velasco, D.A, Hocker, B.
Deposit date:2020-04-18
Release date:2021-07-21
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.876 Å)
Cite:The Stability Landscape of de novo TIM Barrels Explored by a Modular Design Approach.
J.Mol.Biol., 433, 2021
6YQX
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BU of 6yqx by Molmil
Crystal structure of DeNovoTIM13, a de novo designed TIM barrel
Descriptor: CHLORIDE ION, GLYCEROL, de novo designed TIM barrel DeNovoTIM13
Authors:Romero-Romero, S, Kordes, S, Shanmugaratnam, S, Fernandez-Velasco, D.A, Hocker, B.
Deposit date:2020-04-18
Release date:2021-07-21
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (1.638 Å)
Cite:The Stability Landscape of de novo TIM Barrels Explored by a Modular Design Approach.
J.Mol.Biol., 433, 2021
6Z2I
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BU of 6z2i by Molmil
Crystal structure of DeNovoTIM6, a de novo designed TIM barrel
Descriptor: de novo designed TIM barrel DeNovoTIM6
Authors:Romero-Romero, S, Kordes, S, Shanmugaratnam, S, Rodriguez-Romero, A, Fernandez-Velasco, D.A, Hocker, B.
Deposit date:2020-05-15
Release date:2021-07-21
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (2.901 Å)
Cite:The Stability Landscape of de novo TIM Barrels Explored by a Modular Design Approach.
J.Mol.Biol., 433, 2021
7OYY
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BU of 7oyy by Molmil
E.coli's putrescine receptor variant PotF/D (4JDF) with mutation S247D in complex with spermidine
Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Kroeger, P, Shanmugaratnam, S, Hocker, B.
Deposit date:2021-06-25
Release date:2021-12-01
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.36 Å)
Cite:Fine-tuning spermidine binding modes in the putrescine binding protein PotF.
J.Biol.Chem., 297, 2021
6EJZ
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BU of 6ejz by Molmil
Tryptophan Repressor TrpR from E.coli variant S88Y with Indole-3-acetic acid as ligand
Descriptor: 1,2-ETHANEDIOL, 1H-INDOL-3-YLACETIC ACID, SULFATE ION, ...
Authors:Stiel, A.C, Shanmugaratnam, S, Herud-Sikimic, O, Juergens, G, Hocker, B.
Deposit date:2017-09-24
Release date:2019-02-06
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:A biosensor for the direct visualization of auxin
Nature, 2021
6ELF
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BU of 6elf by Molmil
Tryptophan Repressor TrpR from E.coli variant M42F T44L T81I S88Y with Indole-3-acetic acid as ligand
Descriptor: 1H-INDOL-3-YLACETIC ACID, Trp operon repressor
Authors:Stiel, A.C, Shanmugaratnam, S, Herud-Sikimic, O, Juergens, G, Hocker, B.
Deposit date:2017-09-28
Release date:2019-02-06
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.832 Å)
Cite:A biosensor for the direct visualization of auxin
Nature, 2021
6EKP
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BU of 6ekp by Molmil
Tryptophan Repressor TrpR from E.coli variant T44L T81M S88Y with Indole-3-acetic acid as ligand
Descriptor: 1H-INDOL-3-YLACETIC ACID, 3,6,9,12,15-PENTAOXAHEPTADECANE, Trp operon repressor
Authors:Stiel, A.C, Shanmugaratnam, S, Herud-Sikimic, O, Juergens, G, Hocker, B.
Deposit date:2017-09-26
Release date:2019-01-30
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.46 Å)
Cite:A biosensor for the direct visualization of auxin
Nature, 2021
6ENN
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BU of 6enn by Molmil
Tryptophan Repressor TrpR from E.coli variant T44L T81M N87G S88Y with Indole-3-acetic acid as ligand
Descriptor: 1H-INDOL-3-YLACETIC ACID, Trp operon repressor
Authors:Stiel, A.C, Shanmugaratnam, S, Herud-Sikimic, O, Juergens, G, Hocker, B.
Deposit date:2017-10-05
Release date:2019-02-06
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.17 Å)
Cite:A biosensor for the direct visualization of auxin
Nature, 2021
6FAL
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BU of 6fal by Molmil
Tryptophan Repressor TrpR from E.coli with 3-Indolepropionic acid as ligand
Descriptor: INDOLYLPROPIONIC ACID, Trp operon repressor
Authors:Stiel, A.C, Shanmugaratnam, S, Hocker, B.
Deposit date:2017-12-15
Release date:2019-01-30
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:Tryptophan Repressor TrpR from E.coli: A ligand binding study
To Be Published
6F7F
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BU of 6f7f by Molmil
Tryptophan Repressor TrpR from E.coli with 3-Indolepropionic acid
Descriptor: INDOLYLPROPIONIC ACID, Trp operon repressor
Authors:Stiel, A.C, Shanmugaratnam, S, Hocker, B.
Deposit date:2017-12-08
Release date:2019-03-27
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.128 Å)
Cite:Tryptophan Repressor TrpR: A study of ligand binding specificity
To Be Published
6F7G
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BU of 6f7g by Molmil
Tryptophan Repressor TrpR from E.coli with 5-Methyltryptamine
Descriptor: 2-(5-methyl-1~{H}-indol-3-yl)ethanamine, Trp operon repressor
Authors:Stiel, A.C, Shanmugaratnam, S, Hocker, B.
Deposit date:2017-12-08
Release date:2018-12-19
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.656 Å)
Cite:Tryptophan Repressor TrpR: A ligand specificity study
To Be Published
6F9K
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BU of 6f9k by Molmil
Tryptophan Repressor TrpR from E.coli with 5-methyl-L-tryptophan as ligand
Descriptor: 5-methyl-L-tryptophan, SULFATE ION, Trp operon repressor
Authors:Stiel, A.C, Shanmugaratnam, S, Hocker, B.
Deposit date:2017-12-14
Release date:2019-01-30
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.399 Å)
Cite:Tryptophan Repressor TrpR from E.coli: A ligand binding study
To Be Published
2LLE
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BU of 2lle by Molmil
Computational design of an eight-stranded (beta/alpha)-barrel from fragments of different folds
Descriptor: Chemotaxis protein CheY, Imidazole glycerol phosphate synthase subunit HisF chimera
Authors:Coles, M, Truffault, V, Eisenbeis, S, Proffitt, W, Meiler, J, Hocker, B.
Deposit date:2011-11-07
Release date:2012-03-21
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Potential of fragment recombination for rational design of proteins.
J.Am.Chem.Soc., 134, 2012
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