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1L5A
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BU of 1l5a by Molmil
Crystal Structure of VibH, an NRPS Condensation Enzyme
分子名称: amide synthase
著者Keating, T.A, Marshall, C.G, Walsh, C.T, Keating, A.E.
登録日2002-03-06
公開日2002-06-26
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.55 Å)
主引用文献The structure of VibH represents nonribosomal peptide synthetase condensation, cyclization and epimerization domains.
Nat.Struct.Biol., 9, 2002
4GFD
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BU of 4gfd by Molmil
Thymidylate kinase (TMK) from S. Aureus in complex with TK-666
分子名称: 2-(3-bromophenoxy)-4-{(1R)-3,3-dimethyl-1-[(3S)-3-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)piperidin-1-yl]butyl}benzoic acid, Thymidylate kinase
著者Olivier, N.B, Martinez-Botella, G, Keating, T.
登録日2012-08-03
公開日2012-10-24
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献In Vivo Validation of Thymidylate Kinase (TMK) with a Rationally Designed, Selective Antibacterial Compound.
Acs Chem.Biol., 7, 2012
3TWD
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BU of 3twd by Molmil
glmuC1 in complex with an antibacterial inhibitor
分子名称: 4-({5-[(4-aminophenyl)(phenyl)sulfamoyl]-2,4-dimethoxyphenyl}amino)-4-oxobutanoic acid, Bifunctional protein glmU, SULFATE ION
著者Lahiri, S, Otterbein, L.
登録日2011-09-21
公開日2011-10-19
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献In Vitro Validation of Acetyltransferase Activity of GlmU as an Antibacterial Target in Haemophilus influenzae.
J.Biol.Chem., 286, 2011
4QG7
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BU of 4qg7 by Molmil
S.aureus TMK in complex with a potent inhibitor compound 18, 2-(3-CHLOROPHENOXY)-3-METHOXY-4-{[(3S)-3-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)PIPERIDIN-1-YL]METHYL}BENZOIC ACID
分子名称: 2-(3-chlorophenoxy)-3-methoxy-4-{[(3S)-3-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)piperidin-1-yl]methyl}benzoic acid, Thymidylate kinase
著者Olivier, N.B.
登録日2014-05-22
公開日2014-06-11
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (1.67 Å)
主引用文献Antibacterial inhibitors of gram-positive thymidylate kinase: structure-activity relationships and chiral preference of a new hydrophobic binding region.
J.Med.Chem., 57, 2014
4QGA
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S.aureus TMK in complex with potent inhibitor compound 19, 2-(3-CHLOROPHENOXY)-3-FLUORO-4-{[(3S)-3-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)PIPERIDIN-1-YL]METHYL}BENZOIC ACID
分子名称: 2-(3-chlorophenoxy)-3-fluoro-4-{[(3S)-3-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)piperidin-1-yl]methyl}benzoic acid, Thymidylate kinase
著者Olivier, N.B.
登録日2014-05-22
公開日2014-06-11
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.94 Å)
主引用文献Antibacterial inhibitors of gram-positive thymidylate kinase: structure-activity relationships and chiral preference of a new hydrophobic binding region.
J.Med.Chem., 57, 2014
4QGH
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S.aureus TMK in complex with potent inhibitor compound 47
分子名称: 2-(3-chlorophenoxy)-3-fluoro-4-{(1S)-3-methyl-1-[(3S)-3-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)piperidin-1-yl]butyl}benzoic acid, Thymidylate kinase
著者Olivier, N.B.
登録日2014-05-22
公開日2014-06-11
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.78 Å)
主引用文献Antibacterial inhibitors of gram-positive thymidylate kinase: structure-activity relationships and chiral preference of a new hydrophobic binding region.
J.Med.Chem., 57, 2014
4QGF
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S.aureus TMK in complex with the potent inhibitor compound 38, 2-(3-CHLOROPHENOXY)-3-METHOXY-4-{(1R)-1-[(3S)-3-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)PIPERIDIN-1-YL]PROPYL}BENZOIC ACID
分子名称: 2-(3-chlorophenoxy)-3-methoxy-4-{(1R)-1-[(3S)-3-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)piperidin-1-yl]propyl}benzoic acid, Thymidylate kinase
著者Olivier, N.B.
登録日2014-05-22
公開日2014-06-11
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.83 Å)
主引用文献Antibacterial inhibitors of gram-positive thymidylate kinase: structure-activity relationships and chiral preference of a new hydrophobic binding region.
J.Med.Chem., 57, 2014
4QGG
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BU of 4qgg by Molmil
TMK in complex with compound 46, 2-(3-CHLOROPHENOXY)-3-FLUORO-4-{(1R)-3-METHYL-1-[(3S)-3-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)PIPERIDIN-1-YL]BUTYL}BENZOIC ACID
分子名称: 2-(3-chlorophenoxy)-3-fluoro-4-{(1R)-3-methyl-1-[(3S)-3-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)piperidin-1-yl]butyl}benzoic acid, Thymidylate kinase
著者Olivier, N.B.
登録日2014-05-22
公開日2014-06-11
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.62 Å)
主引用文献Antibacterial inhibitors of gram-positive thymidylate kinase: structure-activity relationships and chiral preference of a new hydrophobic binding region.
J.Med.Chem., 57, 2014
4HDC
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Discovery of Selective and Potent Inhibitors of Gram-positive Bacterial Thymidylate Kinase (TMK: Compound 41)
分子名称: 2-(3-chlorophenoxy)-4-{(1R)-3-methyl-1-[(3S)-3-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)piperidin-1-yl]butyl}benzoic acid, Thymidylate kinase
著者Olivier, N.B.
登録日2012-10-02
公開日2012-10-24
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Discovery of Selective and Potent Inhibitors of Gram-Positive Bacterial Thymidylate Kinase (TMK).
J.Med.Chem., 55, 2012
4GSY
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BU of 4gsy by Molmil
Crystal structure of thymidylate kinase from Staphylococcus aureus bound to inhibitor.
分子名称: 4-{[(3S)-3-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)piperidin-1-yl]methyl}-2-[3-(trifluoromethyl)phenoxy]benzoic acid, Thymidylate kinase
著者Larsen, N.A, Olivier, N.B.
登録日2012-08-28
公開日2012-10-24
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.71 Å)
主引用文献Discovery of Selective and Potent Inhibitors of Gram-Positive Bacterial Thymidylate Kinase (TMK).
J.Med.Chem., 55, 2012
4HEJ
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BU of 4hej by Molmil
Discovery of Selective and Potent Inhibitors of Gram-positive Bacterial Thymidylate Kinase (TMK): Compund 16
分子名称: 5-methyl-1-[(3S)-1-{3-[3-(trifluoromethyl)phenoxy]benzyl}piperidin-3-yl]pyrimidine-2,4(1H,3H)-dione, Thymidylate kinase
著者Martinez-Botella, G, Breen, J, Duffy, J, Dumas, J, Geng, B, Gowers, I, Green, O, Guler, S, Hentemann, M, Hernandez-Juan, F, Joseph-McCarthy, D, Kawatkar, S, Larsen, N, Lazari, O, Loch, J, Macritchie, J.
登録日2012-10-03
公開日2012-10-24
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Discovery of Selective and Potent Inhibitors of Gram-Positive Bacterial Thymidylate Kinase (TMK).
J.Med.Chem., 55, 2012
4HLC
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BU of 4hlc by Molmil
Sulfonylpiperidines as Novel, Antibacterial Inhibitors of Gram-Positive Thymidylate Kinase (TMK): Compound 5
分子名称: 4-{[(3S)-3-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)piperidin-1-yl]sulfonyl}-2-(3-methylphenoxy)benzoic acid, Thymidylate kinase
著者Boriack-Sjodin, A, Olivier, N.
登録日2012-10-16
公開日2012-10-31
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Sulfonylpiperidines as novel, antibacterial inhibitors of Gram-positive thymidylate kinase (TMK).
Bioorg.Med.Chem.Lett., 23, 2013
4HLD
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Sulfonylpiperidines as Novel, Antibacterial Inhibitors of Gram-Positive Thymidylate Kinase (TMK): Compound 11
分子名称: 1-[(3S)-1-{[3-(3-chlorophenoxy)-4-hydroxyphenyl]sulfonyl}piperidin-3-yl]-5-methylpyrimidine-2,4(1H,3H)-dione, Thymidylate kinase
著者Olivier, N.
登録日2012-10-16
公開日2012-10-31
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Sulfonylpiperidines as novel, antibacterial inhibitors of Gram-positive thymidylate kinase (TMK).
Bioorg.Med.Chem.Lett., 23, 2013
2JFV
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BU of 2jfv by Molmil
Crystal structure of Enterococcus faecium glutamate racemase in complex with citrate
分子名称: CITRATE ANION, GLUTAMATE RACEMASE
著者Lundqvist, T.
登録日2007-02-06
公開日2007-07-03
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Exploitation of Structural and Regulatory Diversity in Glutamate Racemases
Nature, 447, 2007
2JFP
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BU of 2jfp by Molmil
Crystal structure of Enterococcus faecalis glutamate racemase in complex with D- Glutamate
分子名称: CALCIUM ION, D-GLUTAMIC ACID, GLUTAMATE RACEMASE
著者Lundqvist, T.
登録日2007-02-03
公開日2007-07-03
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.98 Å)
主引用文献Exploitation of Structural and Regulatory Diversity in Glutamate Racemases
Nature, 447, 2007
2JFY
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Crystal structure of Helicobacter pylori glutamate racemase in complex with D-Glutamate
分子名称: D-GLUTAMIC ACID, GLUTAMATE RACEMASE
著者Lundqvist, T.
登録日2007-02-06
公開日2008-02-19
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Exploitation of Structural and Regulatory Diversity in Glutamate Racemases.
Nature, 447, 2007
2JFW
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Crystal structure of Enterococcus faecium glutamate racemase in complex with tartrate
分子名称: GLUTAMATE RACEMASE, L(+)-TARTARIC ACID
著者Lundqvist, T.
登録日2007-02-06
公開日2007-07-03
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Exploitation of Structural and Regulatory Diversity in Glutamate Racemases
Nature, 447, 2007
2JFZ
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BU of 2jfz by Molmil
Crystal structure of Helicobacter pylori glutamate racemase in complex with D-Glutamate and an inhibitor
分子名称: 5-METHYL-7-(2-METHYLPROPYL)-2-(NAPHTHALEN-1-YLMETHYL)-3-PYRIDIN-4-YL-2H-PYRAZOLO[3,4-D]PYRIMIDINE-4,6(5H,7H)-DIONE, D-GLUTAMIC ACID, GLUTAMATE RACEMASE
著者Lundqvist, T.
登録日2007-02-06
公開日2007-07-03
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.86 Å)
主引用文献Exploitation of Structural and Regulatory Diversity in Glutamate Racemases
Nature, 447, 2007
2JFQ
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BU of 2jfq by Molmil
Crystal structure of Staphylococcus aureus glutamate racemase in complex with D- Glutamate
分子名称: D-GLUTAMIC ACID, GLUTAMATE RACEMASE
著者Lundqvist, T.
登録日2007-02-04
公開日2007-07-03
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Exploitation of Structural and Regulatory Diversity in Glutamate Racemases
Nature, 447, 2007
2JFU
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BU of 2jfu by Molmil
Crystal structure of Enterococcus faecium glutamate racemase in complex with phosphate
分子名称: GLUTAMATE RACEMASE, PHOSPHATE ION
著者Lundqvist, T.
登録日2007-02-04
公開日2007-07-03
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Exploitation of Structural and Regulatory Diversity in Glutamate Racemases
Nature, 447, 2007
2JFN
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Crystal structure of Escherichia coli glutamate racemase in complex with L- Glutamate and activator UDP-MurNAc-ala
分子名称: GLUTAMATE RACEMASE, GLUTAMIC ACID, URIDINE-5'-DIPHOSPHATE-N-ACETYLMURAMOYL-L-ALANINE
著者Lundqvist, T.
登録日2007-02-03
公開日2007-07-03
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Exploitation of Structural and Regulatory Diversity in Glutamate Racemases
Nature, 447, 2007
2JFX
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Crystal structure of Helicobacter pylori glutamate racemase in complex with D-Glutamate
分子名称: D-GLUTAMIC ACID, GLUTAMATE RACEMASE
著者Xue, Y, Lundqvist, T.
登録日2007-02-06
公開日2007-07-03
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Exploitation of Structural and Regulatory Diversity in Glutamate Racemases
Nature, 447, 2007
2JFO
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Crystal structure of Enterococcus faecalis glutamate racemase in complex with D- and L-Glutamate
分子名称: D-GLUTAMIC ACID, GLUTAMATE RACEMASE, GLUTAMIC ACID
著者Lundqvist, T.
登録日2007-02-03
公開日2007-07-03
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Exploitation of Structural and Regulatory Diversity in Glutamate Racemases
Nature, 447, 2007

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