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PDB: 158 results

4WK1
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BU of 4wk1 by Molmil
Crystal structure of Staphylococcus aureus PstA in complex with c-di-AMP
Descriptor: (2R,3R,3aS,5R,7aR,9R,10R,10aS,12R,14aR)-2,9-bis(6-amino-9H-purin-9-yl)octahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8 ]tetraoxadiphosphacyclododecine-3,5,10,12-tetrol 5,12-dioxide, CALCIUM ION, PstA
Authors:Mueller, M, Hopfner, K.-P, Witte, G.
Deposit date:2014-10-01
Release date:2014-11-26
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.98 Å)
Cite:c-di-AMP recognition by Staphylococcus aureus PstA.
Febs Lett., 589, 2015
4WK3
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Structure of Staphyloccus aureus PstA
Descriptor: CHLORIDE ION, PstA
Authors:Mueller, M, Hopfner, K.-P, Witte, G.
Deposit date:2014-10-01
Release date:2014-11-26
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:c-di-AMP recognition by Staphylococcus aureus PstA.
Febs Lett., 589, 2015
3LIW
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BU of 3liw by Molmil
Factor XA in complex with (R)-2-(1-ADAMANTYLCARBAMOYLAMINO)-3-(3-CARBAMIDOYL-PHENYL)-N-PHENETHYL-PROPIONIC ACID AMIDE
Descriptor: (R)-2-(3-ADAMANTAN-1-YL-UREIDO)-3-(3-CARBAMIMIDOYL-PHENYL)-N-PHENETHYL-PROPIONAMIDE, Activated factor Xa heavy chain, CALCIUM ION, ...
Authors:Mueller, M.M, Sperl, S, Sturzebecher, J, Bode, W, Moroder, L.
Deposit date:2010-01-25
Release date:2010-04-07
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.22 Å)
Cite:(R)-3-Amidinophenylalanine-Derived Inhibitors of Factor Xa with a Novel Active-Site Binding Mode
Biol.Chem., 383, 2003
2WCD
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BU of 2wcd by Molmil
Crystal structure of the assembled cytolysin A pore
Descriptor: ETHYL MERCURY ION, HEMOLYSIN E, CHROMOSOMAL
Authors:Mueller, M, Grauschopf, U, Maier, T, Glockshuber, R, Ban, N.
Deposit date:2009-03-11
Release date:2009-05-05
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (3.29 Å)
Cite:The Structure of a Cytolytic Alpha-Helical Toxin Pore Reveals its Assembly Mechanism
Nature, 459, 2009
8OOZ
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BU of 8ooz by Molmil
Glutamine synthetase from Methermicoccus shengliensis in complex with MgATP at 2.7 A resolution
Descriptor: ADENOSINE-5'-TRIPHOSPHATE, FORMIC ACID, GLYCEROL, ...
Authors:Mueller, M.-C, Lemaire, O.N, Wagner, T.
Deposit date:2023-04-06
Release date:2024-01-24
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Differences in regulation mechanisms of glutamine synthetases from methanogenic archaea unveiled by structural investigations.
Commun Biol, 7, 2024
8OOW
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BU of 8oow by Molmil
Glutamine synthetase from Methermicoccus shengliensis at a resolution of 2.64 A
Descriptor: 1,2-ETHANEDIOL, GLYCEROL, Glutamine synthetase, ...
Authors:Mueller, M.-C, Lemaire, O.N, Wagner, T.
Deposit date:2023-04-06
Release date:2024-01-24
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.64 Å)
Cite:Differences in regulation mechanisms of glutamine synthetases from methanogenic archaea unveiled by structural investigations.
Commun Biol, 7, 2024
8OOX
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BU of 8oox by Molmil
Glutamine synthetase from Methermicoccus shengliensis at a resolution of 3.09 A
Descriptor: CITRIC ACID, GLYCEROL, Glutamine synthetase, ...
Authors:Mueller, M.-C, Lemaire, O.N, Wagner, T.
Deposit date:2023-04-06
Release date:2024-01-24
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (3.09 Å)
Cite:Differences in regulation mechanisms of glutamine synthetases from methanogenic archaea unveiled by structural investigations.
Commun Biol, 7, 2024
8OON
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BU of 8oon by Molmil
Glutamine synthetase from Methanothermococcus thermolithotrophicus at a resolution of 2.43 A
Descriptor: 1,2-ETHANEDIOL, GLYCEROL, Glutamine synthetase from Methanothermococcus thermolithotrophicus, ...
Authors:Mueller, M.-C, Lemaire, O.N, Wagner, T.
Deposit date:2023-04-05
Release date:2024-01-24
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.43 Å)
Cite:Differences in regulation mechanisms of glutamine synthetases from methanogenic archaea unveiled by structural investigations.
Commun Biol, 7, 2024
8OOQ
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BU of 8ooq by Molmil
Glutamine synthetase from Methanothermococcus thermolithotrophicus in complex with 2-oxoglutarate and Mg at 2.91 A resolution
Descriptor: 1,2-ETHANEDIOL, 2-OXOGLUTARIC ACID, DI(HYDROXYETHYL)ETHER, ...
Authors:Mueller, M.-C, Wagner, T.
Deposit date:2023-04-05
Release date:2024-01-24
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.91 Å)
Cite:Differences in regulation mechanisms of glutamine synthetases from methanogenic archaea unveiled by structural investigations.
Commun Biol, 7, 2024
8OOL
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BU of 8ool by Molmil
Glutamine synthetase from Methanothermococcus thermolithotrophicus with TbXo4 at a resolution of 1.65 A
Descriptor: GLYCEROL, Glutamine synthetase from Methanothermococcus thermolithotrophicus, SULFATE ION, ...
Authors:Mueller, M.-C, Wagner, T.
Deposit date:2023-04-05
Release date:2024-01-24
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Differences in regulation mechanisms of glutamine synthetases from methanogenic archaea unveiled by structural investigations.
Commun Biol, 7, 2024
8OOO
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BU of 8ooo by Molmil
Glutamine synthetase from Methanothermococcus thermolithotrophicus in complex with 2-oxoglutarate and MgATP at 2.15 A resolution
Descriptor: 1,2-ETHANEDIOL, 2-OXOGLUTARIC ACID, ADENOSINE-5'-TRIPHOSPHATE, ...
Authors:Mueller, M.-C, Wagner, T.
Deposit date:2023-04-05
Release date:2024-01-24
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.149 Å)
Cite:Differences in regulation mechanisms of glutamine synthetases from methanogenic archaea unveiled by structural investigations.
Commun Biol, 7, 2024
7NKG
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BU of 7nkg by Molmil
Methyl-coenzyme M reductase from Methermicoccus shengliensis at 1.6-A resolution
Descriptor: 1-THIOETHANESULFONIC ACID, Coenzyme B, FACTOR 430, ...
Authors:Mueller, M, Wagner, T.
Deposit date:2021-02-18
Release date:2021-05-19
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Structural Insights into the Methane-Generating Enzyme from a Methoxydotrophic Methanogen Reveal a Restrained Gallery of Post-Translational Modifications.
Microorganisms, 9, 2021
6HWU
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BU of 6hwu by Molmil
Crystal structure of p38alpha in complex with a photoswitchable 2-Azothiazol-based Inhibitor (compound 2)
Descriptor: 3-(2,5-dimethoxyphenyl)-~{N}-[4-[4-(4-fluorophenyl)-2-[(~{E})-phenyldiazenyl]-1,3-thiazol-5-yl]pyridin-2-yl]propanamide, Mitogen-activated protein kinase 14, octyl beta-D-glucopyranoside
Authors:Mueller, M.P, Rauh, D.
Deposit date:2018-10-15
Release date:2019-04-17
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:2-Azo-, 2-diazocine-thiazols and 2-azo-imidazoles as photoswitchable kinase inhibitors: limitations and pitfalls of the photoswitchable inhibitor approach.
Photochem. Photobiol. Sci., 18, 2019
6HWT
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BU of 6hwt by Molmil
Crystal structure of p38alpha in complex with a reduced photoswitchable 2-Azothiazol-based Inhibitor (compound 31)
Descriptor: 3-(2,5-dimethoxyphenyl)-~{N}-[4-[4-(4-fluorophenyl)-2-(2-phenylhydrazinyl)-1,3-thiazol-5-yl]pyridin-2-yl]propanamide, Mitogen-activated protein kinase 14, octyl beta-D-glucopyranoside
Authors:Mueller, M.P, Rauh, D.
Deposit date:2018-10-15
Release date:2019-04-17
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:2-Azo-, 2-diazocine-thiazols and 2-azo-imidazoles as photoswitchable kinase inhibitors: limitations and pitfalls of the photoswitchable inhibitor approach.
Photochem. Photobiol. Sci., 18, 2019
3NKU
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BU of 3nku by Molmil
Crystal structure of the N-terminal domain of DrrA/SidM from Legionella pneumophila
Descriptor: DI(HYDROXYETHYL)ETHER, DrrA, TRIETHYLENE GLYCOL
Authors:Mueller, M.P, Peters, H, Blankenfeldt, W, Goody, R.S, Itzen, A.
Deposit date:2010-06-21
Release date:2010-08-04
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:The Legionella effector protein DrrA AMPylates the membrane traffic regulator Rab1b.
Science, 329, 2010
3NKV
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BU of 3nkv by Molmil
Crystal structure of Rab1b covalently modified with AMP at Y77
Descriptor: ADENOSINE MONOPHOSPHATE, BARIUM ION, MAGNESIUM ION, ...
Authors:Mueller, M.P, Peters, H, Blankenfeldt, W, Goody, R.S, Itzen, A.
Deposit date:2010-06-21
Release date:2010-08-04
Last modified:2017-08-23
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:The Legionella effector protein DrrA AMPylates the membrane traffic regulator Rab1b.
Science, 329, 2010
7P4Y
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BU of 7p4y by Molmil
GlnK2 from Methanothermococcus thermolithotrophicus in the apo state at a resolution of 2.3 A
Descriptor: CHLORIDE ION, GlnK2 from Methanothermococcus thermolithotrophicus
Authors:Mueller, M.-C, Wagner, T.
Deposit date:2021-07-13
Release date:2021-10-06
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:The Oxoglutarate Binding Site and Regulatory Mechanism Are Conserved in Ammonium Transporter Inhibitors GlnKs from Methanococcales .
Int J Mol Sci, 22, 2021
7P50
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BU of 7p50 by Molmil
GlnK2 from Methanothermococcus thermolithotrophicus in complex with Mg-ATP and 2-oxoglutarate at a resolution of 1.16 A
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 2-OXOGLUTARIC ACID, ADENOSINE-5'-TRIPHOSPHATE, ...
Authors:Mueller, M.-C, Wagner, T.
Deposit date:2021-07-13
Release date:2021-10-06
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.16 Å)
Cite:The Oxoglutarate Binding Site and Regulatory Mechanism Are Conserved in Ammonium Transporter Inhibitors GlnKs from Methanococcales .
Int J Mol Sci, 22, 2021
6HWV
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BU of 6hwv by Molmil
Crystal structure of p38alpha in complex with a photoswitchable 2-Azoimidazol-based Inhibitor (compound 3)
Descriptor: 3-(2,5-dimethoxyphenyl)-~{N}-[4-[5-(4-fluorophenyl)-2-[(~{E})-(4-fluorophenyl)diazenyl]-3-methyl-imidazol-4-yl]pyridin-2-yl]propanamide, Mitogen-activated protein kinase 14, octyl beta-D-glucopyranoside
Authors:Mueller, M.P, Rauh, D.
Deposit date:2018-10-15
Release date:2019-04-17
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:2-Azo-, 2-diazocine-thiazols and 2-azo-imidazoles as photoswitchable kinase inhibitors: limitations and pitfalls of the photoswitchable inhibitor approach.
Photochem. Photobiol. Sci., 18, 2019
4YVZ
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BU of 4yvz by Molmil
Structure of Thermotoga maritima DisA in complex with 3'-dATP/Mn2+
Descriptor: 3'-DEOXYADENOSINE-5'-TRIPHOSPHATE, DNA integrity scanning protein DisA, MANGANESE (II) ION
Authors:Mueller, M, Deimling, T, Hopfner, K.-P, Witte, G.
Deposit date:2015-03-20
Release date:2015-06-03
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.495 Å)
Cite:Structural analysis of the diadenylate cyclase reaction of DNA-integrity scanning protein A (DisA) and its inhibition by 3'-dATP.
Biochem.J., 469, 2015
4YXM
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BU of 4yxm by Molmil
Structure of Thermotoga maritima DisA D75N mutant with reaction product c-di-AMP
Descriptor: (2R,3R,3aS,5R,7aR,9R,10R,10aS,12R,14aR)-2,9-bis(6-amino-9H-purin-9-yl)octahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8 ]tetraoxadiphosphacyclododecine-3,5,10,12-tetrol 5,12-dioxide, (4S)-2-METHYL-2,4-PENTANEDIOL, DNA integrity scanning protein DisA
Authors:Mueller, M, Deimling, T, Hopfner, K.-P, Witte, G.
Deposit date:2015-03-23
Release date:2015-06-03
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Structural analysis of the diadenylate cyclase reaction of DNA-integrity scanning protein A (DisA) and its inhibition by 3'-dATP.
Biochem.J., 469, 2015
4YXJ
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BU of 4yxj by Molmil
Structure of Thermotoga maritima DisA in complex with ApCpp
Descriptor: DIPHOSPHOMETHYLPHOSPHONIC ACID ADENOSYL ESTER, DNA integrity scanning protein DisA
Authors:Mueller, M, Deimling, T, Hopfner, K.-P, Witte, G.
Deposit date:2015-03-23
Release date:2015-06-03
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:Structural analysis of the diadenylate cyclase reaction of DNA-integrity scanning protein A (DisA) and its inhibition by 3'-dATP.
Biochem.J., 469, 2015
7P4V
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BU of 7p4v by Molmil
GlnK1 from Methanothermococcus thermolithotrophicus with dADP at a resolution of 1.94 A
Descriptor: 2'-DEOXYADENOSINE-5'-DIPHOSPHATE, CHLORIDE ION, GlnK1 from Methanothermococcus thermolithotrophicus
Authors:Mueller, M.-C, Wagner, T.
Deposit date:2021-07-13
Release date:2021-10-06
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.94 Å)
Cite:The Oxoglutarate Binding Site and Regulatory Mechanism Are Conserved in Ammonium Transporter Inhibitors GlnKs from Methanococcales .
Int J Mol Sci, 22, 2021
7P52
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BU of 7p52 by Molmil
GlnK1 from Methanocaldococcus jannaschii with Mg-ATP and 2-oxoglutarate at a resolution of 1.2 A
Descriptor: 2-OXOGLUTARIC ACID, ADENOSINE-5'-TRIPHOSPHATE, GLYCEROL, ...
Authors:Mueller, M.-C, Wagner, T.
Deposit date:2021-07-13
Release date:2021-10-06
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.20002 Å)
Cite:The Oxoglutarate Binding Site and Regulatory Mechanism Are Conserved in Ammonium Transporter Inhibitors GlnKs from Methanococcales .
Int J Mol Sci, 22, 2021
4UQG
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BU of 4uqg by Molmil
A new bio-isosteric base pair based on reversible bonding
Descriptor: 5'-D(*AP*GP*GP*GP*A SAYP*GP*GP*TP*CP)-3', 5'-D(*GP*AP*CP*C T0TP*TP*CP*CP*CP*TP)-3', DNA POLYMERASE, ...
Authors:Tomas-Gamasa, M, Serdjukov, S, Su, M, Mueller, M, Carell, T.
Deposit date:2014-06-23
Release date:2014-12-03
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2 Å)
Cite:"Post-it" type connected DNA created with a reversible covalent cross-link.
Angew. Chem. Int. Ed. Engl., 54, 2015

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