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4XNI
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BU of 4xni by Molmil
X-ray structure of PepTst1
分子名称: (2S)-2,3-DIHYDROXYPROPYL(7Z)-PENTADEC-7-ENOATE, Di-or tripeptide:H+ symporter, PHOSPHATE ION
著者Huang, C.Y, Olieric, V, Diederichs, K, Wang, M, Caffrey, M.
登録日2015-01-15
公開日2015-06-03
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献In meso in situ serial X-ray crystallography of soluble and membrane proteins.
Acta Crystallogr.,Sect.D, 71, 2015
4XNK
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BU of 4xnk by Molmil
X-ray structure of AlgE1
分子名称: (2S)-2,3-DIHYDROXYPROPYL(7Z)-PENTADEC-7-ENOATE, 3,6,9,12,15,18,21,24-OCTAOXAHEXACOSAN-1-OL, Alginate production protein AlgE, ...
著者Ma, P, Huang, C.Y, Olieric, V, Diederichs, K, Wang, M, Caffrey, M.
登録日2015-01-15
公開日2015-06-03
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献In meso in situ serial X-ray crystallography of soluble and membrane proteins.
Acta Crystallogr.,Sect.D, 71, 2015
4WN1
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BU of 4wn1 by Molmil
Crystal structure of PDE10A in complex with 1-methyl-5-(1-methyl-3-{[4-(quinolin-2-yl)phenoxy]methyl}-1H-pyrazol-4-yl)pyridin-2(1H)-one
分子名称: 1-methyl-5-(1-methyl-3-{[4-(quinolin-2-yl)phenoxy]methyl}-1H-pyrazol-4-yl)pyridin-2(1H)-one, MAGNESIUM ION, ZINC ION, ...
著者Amano, Y, Honbou, K.
登録日2014-10-10
公開日2014-12-31
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (3.13 Å)
主引用文献Synthesis, SAR study, and biological evaluation of novel quinoline derivatives as phosphodiesterase 10A inhibitors with reduced CYP3A4 inhibition.
Bioorg.Med.Chem., 23, 2015
4XJB
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BU of 4xjb by Molmil
X-ray structure of Lysozyme1
分子名称: CHLORIDE ION, Lysozyme C, SODIUM ION
著者Huang, C.Y, Olieric, V, Diederichs, K, Wang, M, Caffrey, M.
登録日2015-01-08
公開日2015-06-03
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献In meso in situ serial X-ray crystallography of soluble and membrane proteins.
Acta Crystallogr.,Sect.D, 71, 2015
4XJG
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BU of 4xjg by Molmil
X-ray structure of Lysozyme B2
分子名称: BROMIDE ION, Lysozyme C, SODIUM ION
著者Huang, C.Y, Olieric, V, Diederichs, K, Wang, M, Caffrey, M.
登録日2015-01-08
公開日2015-06-03
最終更新日2015-06-17
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献In meso in situ serial X-ray crystallography of soluble and membrane proteins.
Acta Crystallogr.,Sect.D, 71, 2015
4XJI
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BU of 4xji by Molmil
X-ray structure of LysozymeS2
分子名称: CHLORIDE ION, Lysozyme C, SODIUM ION
著者Huang, C.Y, Olieric, V, Diederichs, K, Wang, M, Caffrey, M.
登録日2015-01-08
公開日2015-06-03
最終更新日2015-06-17
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献In meso in situ serial X-ray crystallography of soluble and membrane proteins.
Acta Crystallogr.,Sect.D, 71, 2015
4XJD
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BU of 4xjd by Molmil
X-ray structure of Lysozyme2
分子名称: CHLORIDE ION, Lysozyme C, SODIUM ION
著者Huang, C.Y, Olieric, V, Diederichs, K, Wang, M, Caffrey, M.
登録日2015-01-08
公開日2015-06-03
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.801 Å)
主引用文献In meso in situ serial X-ray crystallography of soluble and membrane proteins.
Acta Crystallogr.,Sect.D, 71, 2015
4XJH
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BU of 4xjh by Molmil
X-ray structure of LysozymeS1
分子名称: CHLORIDE ION, Lysozyme C, SODIUM ION
著者Huang, C.Y, Olieric, V, Diederichs, K, Wang, M, Caffrey, M.
登録日2015-01-08
公開日2015-06-03
最終更新日2015-06-17
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献In meso in situ serial X-ray crystallography of soluble and membrane proteins.
Acta Crystallogr.,Sect.D, 71, 2015
9BFT
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BU of 9bft by Molmil
Cryo-EM co-structure of AcrB with CU244
分子名称: (2S)-1-{[(1R,5R)-3-azabicyclo[3.1.0]hexan-6-yl]amino}-3-(3,5-dichlorophenoxy)propan-2-ol, 1,2-Distearoyl-sn-glycerophosphoethanolamine, Multidrug efflux pump subunit AcrB
著者Su, C.C.
登録日2024-04-18
公開日2024-05-08
実験手法ELECTRON MICROSCOPY (2.44 Å)
主引用文献Bacterial efflux pump modulators prevent bacterial growth in macrophages and under broth conditions that mimic the host environment.
mBio, 14, 2023
8TWR
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BU of 8twr by Molmil
Influenza A virus (A/Aichi/2/1968(H3N2) nucleoprotein mutant - 2-7 deleted, P283S, R416A
分子名称: Nucleoprotein, SODIUM ION
著者Yoon, J, Zhang, Y.M, Grant, R.A, Shoulders, M.D.
登録日2023-08-21
公開日2024-07-03
最終更新日2024-07-10
実験手法X-RAY DIFFRACTION (3.09 Å)
主引用文献The immune-evasive proline-283 substitution in influenza nucleoprotein increases aggregation propensity without altering the native structure.
Sci Adv, 10, 2024
8TWP
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BU of 8twp by Molmil
Influenza A virus (A/Aichi/2/1968(H3N2) nucleoprotein mutant - 2-7 deleted, R416A
分子名称: Nucleoprotein
著者Yoon, J, Zhang, Y.M, Grant, R.A, Shoulders, M.D.
登録日2023-08-21
公開日2024-07-03
最終更新日2024-07-10
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献The immune-evasive proline-283 substitution in influenza nucleoprotein increases aggregation propensity without altering the native structure.
Sci Adv, 10, 2024
9BFN
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BU of 9bfn by Molmil
Cryo-EM co-structure of AcrB with the CU232 efflux pump inhibitor
分子名称: (2R)-1-(4-aminopiperidin-1-yl)-3-[3-(trifluoromethyl)phenoxy]propan-2-ol, 1,2-Distearoyl-sn-glycerophosphoethanolamine, Multidrug efflux pump subunit AcrB
著者Su, C.C.
登録日2024-04-18
公開日2024-05-08
実験手法ELECTRON MICROSCOPY (2.71 Å)
主引用文献Bacterial efflux pump modulators prevent bacterial growth in macrophages and under broth conditions that mimic the host environment.
mBio, 14, 2023
8VLS
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BU of 8vls by Molmil
Structure of VCP in complex with an ATPase activator (D2 domains only, dodecameric form)
分子名称: (3R)-N-[2-(ethylsulfanyl)phenyl]-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide, Transitional endoplasmic reticulum ATPase
著者Jones, N.H, Urnivicius, L, Kapoor, T.M.
登録日2024-01-12
公開日2024-06-19
実験手法ELECTRON MICROSCOPY (2.9 Å)
主引用文献Allosteric activation of VCP, an AAA unfoldase, by small molecule mimicry.
Proc.Natl.Acad.Sci.USA, 121, 2024
8WZU
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BU of 8wzu by Molmil
4-hydroxybutyryl-CoA Synthetase (ADP-forming) from Nitrosopumilus maritimus.
分子名称: 4-hydroxybutyrate--CoA ligase [ADP-forming], SULFATE ION
著者Johnson, J, Demirci, H.
登録日2023-11-02
公開日2024-06-12
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Crystal Structure of 4-hydroxybutyryl CoA synthetase (ADP-forming): A Key Enzyme in the Thaumarchaeal Hydroxypropionate/Hydroxybutyrate cycle.
To Be Published
8VOV
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BU of 8vov by Molmil
Structure of VCP in complex with an ATPase activator and ADP (D2 domains only, hexameric form)
分子名称: (3R)-N-[2-(ethylsulfanyl)phenyl]-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide, ADENOSINE-5'-DIPHOSPHATE, Transitional endoplasmic reticulum ATPase
著者Jones, N.H, Urnivicius, L, Kapoor, T.M.
登録日2024-01-16
公開日2024-06-19
実験手法ELECTRON MICROSCOPY (3.6 Å)
主引用文献Allosteric activation of VCP, an AAA unfoldase, by small molecule mimicry.
Proc.Natl.Acad.Sci.USA, 121, 2024
8VKU
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BU of 8vku by Molmil
Structure of VCP in complex with an ATPase activator (D2 domains only, hexameric form)
分子名称: (3R)-N-[2-(ethylsulfanyl)phenyl]-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide, Transitional endoplasmic reticulum ATPase
著者Jones, N.H, Urnivicius, L, Kapoor, T.M.
登録日2024-01-09
公開日2024-06-19
実験手法ELECTRON MICROSCOPY (3.5 Å)
主引用文献Allosteric activation of VCP, an AAA unfoldase, by small molecule mimicry.
Proc.Natl.Acad.Sci.USA, 121, 2024
9EM1
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BU of 9em1 by Molmil
Human pyridoxal phosphatase in complex with 7,8-dihydroxyflavone and phosphate
分子名称: 7,8-bis(oxidanyl)-2-phenyl-chromen-4-one, Chronophin, GLYCEROL, ...
著者Brenner, M, Gohla, A, Schindelin, H.
登録日2024-03-07
公開日2024-06-12
最終更新日2024-06-26
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献7,8-Dihydroxyflavone is a direct inhibitor of human and murine pyridoxal phosphatase.
Elife, 13, 2024
9BFH
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BU of 9bfh by Molmil
Cryo-EM co-structure of AcrB with the CU032 efflux pump inhibitor
分子名称: (2S)-1-[(3R)-3-aminopyrrolidin-1-yl]-3-(3,4-dichlorophenoxy)propan-2-ol, Multidrug efflux pump subunit AcrB
著者Su, C.C.
登録日2024-04-17
公開日2024-05-08
実験手法ELECTRON MICROSCOPY (2.62 Å)
主引用文献Bacterial efflux pump modulators prevent bacterial growth in macrophages and under broth conditions that mimic the host environment.
mBio, 14, 2023
9BFM
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BU of 9bfm by Molmil
Cryo-EM co-structure of AcrB with the EPM35 efflux pump inhibitor
分子名称: (2S)-1-(3,4-dichlorophenoxy)-3-(4-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}piperidin-1-yl)propan-2-ol, Multidrug efflux pump subunit AcrB
著者Su, C.C.
登録日2024-04-18
公開日2024-05-08
実験手法ELECTRON MICROSCOPY (2.71 Å)
主引用文献Bacterial efflux pump modulators prevent bacterial growth in macrophages and under broth conditions that mimic the host environment.
mBio, 14, 2023
1TMO
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BU of 1tmo by Molmil
TRIMETHYLAMINE N-OXIDE REDUCTASE FROM SHEWANELLA MASSILIA
分子名称: GUANYLATE-O'-PHOSPHORIC ACID MONO-(2-AMINO-5,6-DIMERCAPTO-4-OXO-3,5,6,7,8A,9,10,10A-OCTAHYDRO-4H-8-OXA-1,3,9,10-TETRAAZA-ANTHRACEN-7-YLMETHYL) ESTER, MOLYBDENUM (IV)OXIDE, TRIMETHYLAMINE N-OXIDE REDUCTASE
著者Czjzek, M, Dos Santos, J.P, Giordano, G, Mejean, V.
登録日1998-08-03
公開日1999-03-30
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Crystal structure of oxidized trimethylamine N-oxide reductase from Shewanella massilia at 2.5 A resolution.
J.Mol.Biol., 284, 1998
7WNW
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BU of 7wnw by Molmil
Crystal structure of Imine Reductase Mutant(M5) from Actinoalloteichus hymeniacidonis in complex with NADPH
分子名称: 3-hydroxyisobutyrate dehydrogenase-like beta-hydroxyacid dehydrogenase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
著者Zhand, J, Chen, R, Gao, S.
登録日2022-01-19
公開日2022-04-06
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.13 Å)
主引用文献Tuning an Imine Reductase for the Asymmetric Synthesis of Azacycloalkylamines by Concise Structure-Guided Engineering.
Angew.Chem.Int.Ed.Engl., 61, 2022
7WNN
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BU of 7wnn by Molmil
Crystal structure of Imine Reductase from Actinoalloteichus hymeniacidonis in complex with NADPH
分子名称: 3-hydroxyisobutyrate dehydrogenase-like beta-hydroxyacid dehydrogenase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
著者Zhang, J, Chen, R, Gao, S.
登録日2022-01-19
公開日2022-04-06
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (1.53 Å)
主引用文献Tuning an Imine Reductase for the Asymmetric Synthesis of Azacycloalkylamines by Concise Structure-Guided Engineering.
Angew.Chem.Int.Ed.Engl., 61, 2022
7W5C
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BU of 7w5c by Molmil
Crystal structure of Mitogen Activated Protein Kinase 4 (MPK4) from Arabidopsis thaliana
分子名称: MAGNESIUM ION, Mitogen-activated protein kinase 4, Mitogen-activated protein kinase kinase 1, ...
著者Arold, S.T, Hameed, U.F.S.
登録日2021-11-30
公開日2022-12-07
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.201 Å)
主引用文献Essential role of the CD docking motif of MPK4 in plant immunity, growth, and development.
New Phytol., 239, 2023
8P8E
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BU of 8p8e by Molmil
Crystal structure of endolysin gp46 from Pseudomonas aeruginosa bacteriophage vB_PaeM_KTN6
分子名称: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, DI(HYDROXYETHYL)ETHER, Glycoside hydrolase family protein
著者van Raaij, M.J, Sanz-Gaitero, M.
登録日2023-06-01
公開日2024-05-08
実験手法X-RAY DIFFRACTION (1.391 Å)
主引用文献Structural and Biochemical Characterization of a New Phage-Encoded Muramidase, KTN6 Gp46
PHAGE, 2024
7Z2I
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TRYPSIN (BOVINE) COMPLEXED WITH compound 4
分子名称: 5-[[3-(trifluoromethyl)phenyl]methyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine, CALCIUM ION, DIMETHYL SULFOXIDE, ...
著者Schiering, N, Dalvit, C, Vulpetti, A.
登録日2022-02-27
公開日2022-05-25
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.09 Å)
主引用文献Efficient Screening of Target-Specific Selected Compounds in Mixtures by 19 F NMR Binding Assay with Predicted 19 F NMR Chemical Shifts.
Chemmedchem, 17, 2022

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件を2024-07-17に公開中

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