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8SPC
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BU of 8spc by Molmil
Crystal structure of the cytochrome P450 enzyme RufO
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Cytochrome P450, ...
著者Dratch, B.D, Davis, K.M.
登録日2023-05-02
公開日2023-12-13
実験手法X-RAY DIFFRACTION (1.871 Å)
主引用文献Insights into Substrate Recognition by the Unusual Nitrating Enzyme RufO.
Acs Chem.Biol., 18, 2023
8VII
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BU of 8vii by Molmil
EgtB-IV from Crocosphaera subtropica, an ergothioneine-biosynthetic type IV sulfoxide synthase in complex with cysteine and hercynine
分子名称: 1,2-ETHANEDIOL, CYSTEINE, MANGANESE (II) ION, ...
著者Ireland, K.A, Davis, K.M.
登録日2024-01-04
公開日2024-08-07
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (1.621 Å)
主引用文献Structural insights into the convergent evolution of sulfoxide synthase EgtB-IV, an ergothioneine-biosynthetic homolog of ovothiol synthase OvoA.
Structure, 32, 2024
8VIG
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BU of 8vig by Molmil
EgtB-IV from Geminocystis sp. isolate SKYG4, an ergothioneine-biosynthetic type IV sulfoxide synthase in complex with hercynine
分子名称: 1,2-ETHANEDIOL, FE (III) ION, N,N,N-trimethyl-histidine, ...
著者Ireland, K.A, Davis, K.M.
登録日2024-01-04
公開日2024-08-07
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Structural insights into the convergent evolution of sulfoxide synthase EgtB-IV, an ergothioneine-biosynthetic homolog of ovothiol synthase OvoA.
Structure, 32, 2024
8VIK
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BU of 8vik by Molmil
EgtB-IV from Crocosphaera subtropica, a type IV sulfoxide synthase involved in ergothioneine biosynthesis
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, FE (III) ION, ...
著者Ireland, K.A, Davis, K.M.
登録日2024-01-04
公開日2024-08-07
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (1.961 Å)
主引用文献Structural insights into the convergent evolution of sulfoxide synthase EgtB-IV, an ergothioneine-biosynthetic homolog of ovothiol synthase OvoA.
Structure, 32, 2024
8VIL
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BU of 8vil by Molmil
EgtB-IV from Crocosphaera subtropica, an ergothioneine-biosynthetic type IV sulfoxide synthase in complex with N,N-dimethyl-histidine
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, FE (III) ION, ...
著者Ireland, K.A, Davis, K.M.
登録日2024-01-04
公開日2024-08-07
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Structural insights into the convergent evolution of sulfoxide synthase EgtB-IV, an ergothioneine-biosynthetic homolog of ovothiol synthase OvoA.
Structure, 32, 2024
7T6C
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BU of 7t6c by Molmil
E. coli dihydroorotate dehydrogenase bound to the ubiquinone surrogate DCIP
分子名称: 2,6-bis(chloranyl)-4-[(4-hydroxyphenyl)amino]phenol, 2-{2-[2-(2-{2-[2-(2-ETHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHANOL, Dihydroorotate dehydrogenase (quinone), ...
著者Horwitz, S.M, Ambarian, J.A, Davis, K.M.
登録日2021-12-13
公開日2022-03-02
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.53 Å)
主引用文献Structural insights into inhibition of the drug target dihydroorotate dehydrogenase by bacterial hydroxyalkylquinolines.
Rsc Chem Biol, 3, 2022
7T5K
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BU of 7t5k by Molmil
E. coli dihydroorotate dehydrogenase bound to the inhibitor HQNO
分子名称: 2-HEPTYL-4-HYDROXY QUINOLINE N-OXIDE, Dihydroorotate dehydrogenase (quinone), FLAVIN MONONUCLEOTIDE, ...
著者Horwitz, S.M, Ambarian, J.A, Davis, K.M.
登録日2021-12-12
公開日2022-03-02
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Structural insights into inhibition of the drug target dihydroorotate dehydrogenase by bacterial hydroxyalkylquinolines.
Rsc Chem Biol, 3, 2022
8TCC
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BU of 8tcc by Molmil
GTP Cyclohydrolase-IB with dehydrocostus lactone
分子名称: 1,2-ETHANEDIOL, GTP cyclohydrolase FolE2, MANGANESE (II) ION, ...
著者McWhorter, K.L, Amaya Lopez, C.Y, Davis, K.M.
登録日2023-06-30
公開日2024-07-03
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献Combatting melioidosis with chemical synthetic lethality.
Proc.Natl.Acad.Sci.USA, 121, 2024
7T6H
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BU of 7t6h by Molmil
E. coli dihydroorotate dehydrogenase
分子名称: Dihydroorotate dehydrogenase (quinone), FLAVIN MONONUCLEOTIDE, OROTIC ACID
著者Horwitz, S.M, Ambarian, J.A, Davis, K.M.
登録日2021-12-13
公開日2022-03-02
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.42 Å)
主引用文献Structural insights into inhibition of the drug target dihydroorotate dehydrogenase by bacterial hydroxyalkylquinolines.
Rsc Chem Biol, 3, 2022
7T5Y
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BU of 7t5y by Molmil
E. coli dihydroorotate dehydrogenase bound to the inhibitor HMNQ
分子名称: 3-methyl-2-[(2E)-non-2-en-1-yl]quinolin-4(1H)-one, Dihydroorotate dehydrogenase (quinone), FLAVIN MONONUCLEOTIDE, ...
著者Horwitz, S.M, Ambarian, J.A, Davis, K.M.
登録日2021-12-13
公開日2022-03-02
最終更新日2024-12-25
実験手法X-RAY DIFFRACTION (2.62 Å)
主引用文献Structural insights into inhibition of the drug target dihydroorotate dehydrogenase by bacterial hydroxyalkylquinolines.
Rsc Chem Biol, 3, 2022
4PBU
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BU of 4pbu by Molmil
Serial Time-resolved crystallography of Photosystem II using a femtosecond X-ray laser The S1 state
分子名称: 1,2-DI-O-ACYL-3-O-[6-DEOXY-6-SULFO-ALPHA-D-GLUCOPYRANOSYL]-SN-GLYCEROL, 1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLE, 2,3-DIMETHYL-5-(3,7,11,15,19,23,27,31,35-NONAMETHYL-2,6,10,14,18,22,26,30,34-HEXATRIACONTANONAENYL-2,5-CYCLOHEXADIENE-1,4-DIONE-2,3-DIMETHYL-5-SOLANESYL-1,4-BENZOQUINONE, ...
著者Kupitz, C, Basu, S, Grotjohann, I, Fromme, R, Zatsepin, N, Rendek, K.N, Hunter, M, Shoeman, R.L, White, T.A, Wang, D, James, D, Yang, J.H, Cobb, D.E, Reeder, B, Sierra, R.G, Liu, H, Barty, A, Aquila, A, Deponte, D, Kirian, R.A, Bari, S, Bergkamp, J.J, Beyerlein, K, Bogan, M.J, Caleman, C, Chao, T.-C, Conrad, C.E, Davis, K.M, Fleckenstein, H, Galli, L, Hau-Riege, S.P, Kassemeyer, S, Laksmono, H, Liang, M, Lomb, L, Marchesini, S, Martin, A.V, Messerschmidt, M, Milathianaki, D, Nass, K, Ros, A, Roy-Chowdhury, S, Schmidt, K, Seibert, M, Steinbrener, J, Stellato, F, Yan, L, Yoon, C, Moore, T.A, Moore, A.L, Pushkar, Y, Williams, G.J, Boutet, S, Doak, R.B, Weierstall, U, Frank, M, Chapman, H.N, Spence, J.C.H, Fromme, P.
登録日2014-04-13
公開日2014-07-16
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (5 Å)
主引用文献Serial time-resolved crystallography of photosystem II using a femtosecond X-ray laser.
Nature, 513, 2014
4RVY
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BU of 4rvy by Molmil
Serial Time resolved crystallography of Photosystem II using a femtosecond X-ray laser. The S state after two flashes (S3)
分子名称: 1,2-DI-O-ACYL-3-O-[6-DEOXY-6-SULFO-ALPHA-D-GLUCOPYRANOSYL]-SN-GLYCEROL, 1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLE, 1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDE, ...
著者Kupitz, C, Basu, S, Grotjohann, I, Fromme, R, Zatsepin, N, Rendek, K.N, Hunter, M, Shoeman, R.L, White, T.A, Wang, D, James, D, Yang, J.-H, Cobb, D.E, Reeder, B, Sierra, R.G, Liu, H, Barty, A, Aquila, A, Deponte, D, Kirian, R, Bari, S, Bergkamp, J.J, Beyerlein, K, Bogan, M.J, Caleman, C, Chao, T.-C, Conrad, C.E, Davis, K.M, Fleckenstein, H, Galli, L, Hau-Riege, S.P, Kassemeyer, S, Laksmono, H, Liang, M, Lomb, L, Marchesini, S, Martin, A.V, Messerschmidt, M, Milathianaki, D, Nass, K, Ros, A, Roy-Chowdhury, S, Schmidt, K, Seibert, M, Steinbrener, J, Stellato, F, Yan, L, Yoon, C, Moore, T.A, Moore, A.L, Pushkar, Y, Williams, G.J, Boutet, S, Doak, R.B, Weierstall, U, Frank, M, Chapman, H.N, Spence, J.C.H, Fromme, P.
登録日2014-11-29
公開日2015-11-04
最終更新日2024-11-27
実験手法X-RAY DIFFRACTION (5.5 Å)
主引用文献Serial time-resolved crystallography of photosystem II using a femtosecond X-ray laser.
Nature, 513, 2014
9BXH
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BU of 9bxh by Molmil
OvsM from Marinimicrobium koreense, a SAM-dependent N-methyltransferase involved in ovoselenol biosynthesis
分子名称: 1,2-ETHANEDIOL, 5-selenohistidine N-methyltransferase OvsM
著者Ireland, K.A, Davis, K.M.
登録日2024-05-22
公開日2025-01-08
最終更新日2025-03-19
実験手法X-RAY DIFFRACTION (1.48 Å)
主引用文献Structural and functional analysis of SAM-dependent N-methyltransferases involved in ovoselenol and ovothiol biosynthesis.
Structure, 33, 2025
9BXM
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BU of 9bxm by Molmil
OvoM from Sulfuricurvum sp. isolate STB_99, a SAM-dependent N-methyltransferase involved in ovothiol biosynthesis
分子名称: 1,2-ETHANEDIOL, 5-thiohistidine N-methyltransferase OvoM
著者Ireland, K.A, Davis, K.M.
登録日2024-05-22
公開日2025-01-08
最終更新日2025-03-19
実験手法X-RAY DIFFRACTION (2.27 Å)
主引用文献Structural and functional analysis of SAM-dependent N-methyltransferases involved in ovoselenol and ovothiol biosynthesis.
Structure, 33, 2025
9BXJ
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BU of 9bxj by Molmil
OvsM from Marinimicrobium koreense, an ovoselenol-biosynthetic N-methyltransferase in complex with SAM
分子名称: 1,2-ETHANEDIOL, 5-selenohistidine N-methyltransferase OvsM, S-ADENOSYLMETHIONINE
著者Ireland, K.A, Davis, K.M.
登録日2024-05-22
公開日2025-01-08
最終更新日2025-03-19
実験手法X-RAY DIFFRACTION (1.56 Å)
主引用文献Structural and functional analysis of SAM-dependent N-methyltransferases involved in ovoselenol and ovothiol biosynthesis.
Structure, 33, 2025
9BXL
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BU of 9bxl by Molmil
OvoM from Sulfuricurvum sp. isolate STB_99, an ovothiol-biosynthetic N-methyltransferase in complex with SAM
分子名称: 1,2-ETHANEDIOL, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 5-thiohistidine N-methyltransferase OvoM, ...
著者Ireland, K.A, Davis, K.M.
登録日2024-05-22
公開日2025-01-08
最終更新日2025-03-19
実験手法X-RAY DIFFRACTION (2.09 Å)
主引用文献Structural and functional analysis of SAM-dependent N-methyltransferases involved in ovoselenol and ovothiol biosynthesis.
Structure, 33, 2025
9BXN
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BU of 9bxn by Molmil
OvoM from Sulfuricurvum sp. isolate STB_99, an ovothiol-biosynthetic N-methyltransferase in complex with 5-thiohistidine and SAH
分子名称: 1,2-ETHANEDIOL, 5-sulfanyl-L-histidine, 5-thiohistidine N-methyltransferase OvoM, ...
著者Ireland, K.A, Davis, K.M.
登録日2024-05-22
公開日2025-01-08
最終更新日2025-03-19
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Structural and functional analysis of SAM-dependent N-methyltransferases involved in ovoselenol and ovothiol biosynthesis.
Structure, 33, 2025
9BXK
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BU of 9bxk by Molmil
OvsM from Marinimicrobium koreense, an ovoselenol-biosynthetic N-methyltransferase in complex with 5-selenohistidine and SAH
分子名称: 1,2-ETHANEDIOL, 5-selanyl-L-histidine, 5-selenohistidine N-methyltransferase OvsM, ...
著者Ireland, K.A, Davis, K.M.
登録日2024-05-22
公開日2025-01-08
最終更新日2025-03-19
実験手法X-RAY DIFFRACTION (1.66 Å)
主引用文献Structural and functional analysis of SAM-dependent N-methyltransferases involved in ovoselenol and ovothiol biosynthesis.
Structure, 33, 2025
9CJG
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BU of 9cjg by Molmil
P450-G9 from Actinokineospora terrae, a non-canonical, serine-ligated cytochrome P450 in the ligand-free, closed conformation
分子名称: 1-BUTANOL, Cytochrome P450-G9, FORMIC ACID, ...
著者Ireland, K.A, Davis, K.M.
登録日2024-07-06
公開日2025-03-12
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Non-Canonical Cytochrome P450 Enzymes in Nature.
Biorxiv, 2024
9EBW
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BU of 9ebw by Molmil
Chimeric fluorescence biosensor formed from a lactate-binding protein and GFP, bound to lactate
分子名称: GLYCEROL, Green fluorescent protein,Methyl-accepting chemotaxis transducer (TlpC), LACTIC ACID
著者Horwitz, S.M, Ambarian, J.A, Jones, R, Waidmann, L, Davis, K.M.
登録日2024-11-13
公開日2025-03-19
実験手法X-RAY DIFFRACTION (2.78 Å)
主引用文献State-dependent motion of a genetically encoded fluorescent biosensor.
Proc.Natl.Acad.Sci.USA, 122, 2025
9EBX
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BU of 9ebx by Molmil
Chimeric fluorescence biosensor formed from a lactate-binding protein and GFP
分子名称: Green fluorescent protein,Methyl-accepting chemotaxis transducer (TlpC)
著者Horwitz, S.M, Ambarian, J.A, Waidmann, L, Davis, K.M.
登録日2024-11-13
公開日2025-03-19
実験手法X-RAY DIFFRACTION (2.42 Å)
主引用文献State-dependent motion of a genetically encoded fluorescent biosensor.
Proc.Natl.Acad.Sci.USA, 122, 2025
4XZP
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BU of 4xzp by Molmil
Crystal structure of the N-terminal domain of human galectin-4
分子名称: CALCIUM ION, Galectin-4
著者Rustiguel, J.K, Nonato, M.C.
登録日2015-02-04
公開日2016-03-02
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.48 Å)
主引用文献Full-length model of the human galectin-4 and insights into dynamics of inter-domain communication.
Sci Rep, 6, 2016
7ROO
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BU of 7roo by Molmil
Crystal structure of Friedel-Crafts alkylating enzyme CylK from Cylindospermum licheniforme with bromide
分子名称: 1,2-ETHANEDIOL, BROMIDE ION, CALCIUM ION, ...
著者Ruskoski, T.B, Boal, A.K.
登録日2021-07-31
公開日2022-03-23
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.52 Å)
主引用文献Structural basis for an unprecedented enzymatic alkylation in cylindrocyclophane biosynthesis.
Elife, 11, 2022
7RON
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BU of 7ron by Molmil
Crystal structure of the Friedel-Crafts alkylating enzyme CylK from Cylindospermum licheniforme
分子名称: 1,2-ETHANEDIOL, CALCIUM ION, CHLORIDE ION, ...
著者Ruskoski, T.B, Boal, A.K.
登録日2021-07-31
公開日2022-03-23
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.68 Å)
主引用文献Structural basis for an unprecedented enzymatic alkylation in cylindrocyclophane biosynthesis.
Elife, 11, 2022
6DQX
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BU of 6dqx by Molmil
Actinobacillus ureae class Id ribonucleotide reductase alpha subunit
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, GLYCEROL, ...
著者McBride, M.J, Palowitch, G.M, Boal, A.K.
登録日2018-06-11
公開日2019-04-17
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.76 Å)
主引用文献Structures of Class Id Ribonucleotide Reductase Catalytic Subunits Reveal a Minimal Architecture for Deoxynucleotide Biosynthesis.
Biochemistry, 58, 2019

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