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4YDF
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BU of 4ydf by Molmil
Crystal structure of compound 9 in complex with HTLV-1 Protease
分子名称: HTLV-1 Protease, N-benzyl-N-[(3S,4S)-4-{benzyl[(4-nitrophenyl)sulfonyl]amino}pyrrolidin-3-yl]-3-nitrobenzenesulfonamide, SULFATE ION
著者Kuhnert, M, Blum, A, Steuber, H, Diederich, W.E.
登録日2015-02-22
公開日2016-02-03
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.804 Å)
主引用文献Privileged Structures Meet Human T-Cell Leukemia Virus-1 (HTLV-1): C2-Symmetric 3,4-Disubstituted Pyrrolidines as Nonpeptidic HTLV-1 Protease Inhibitors.
J.Med.Chem., 58, 2015
2N9C
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BU of 2n9c by Molmil
NRAS Isoform 5
分子名称: GTPase NRas
著者Markowitz, J, Mal, T.K, Yuan, C, Courtney, N.B, Patel, M, Stiff, A.R, Blachly, J, Walker, C, Eisfeld, A, de la Chapelle, A, Carson III, W.E.
登録日2015-11-13
公開日2016-03-23
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Structural characterization of NRAS isoform 5.
Protein Sci., 25, 2016
4QB4
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Crystal Structure of Staphylococcal Nuclease mutant V23L/L25V/V66L
分子名称: Thermonuclease
著者Lor, P, Janowska, K, Sakon, J, Stites, W.E.
登録日2014-05-06
公開日2014-06-11
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Crystal Structure of Staphylococcal Nuclease mutant V23L/L25V/V66L
To be Published
9BVY
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BU of 9bvy by Molmil
Neutron Structure of Peroxide-Soaked Tyr34Phe MnSOD
分子名称: HYDROGEN PEROXIDE, MANGANESE (II) ION, Superoxide dismutase [Mn], ...
著者Azadmanesh, J, Slobodnik, K, Struble, L.R, Cone, E.A, Dasgupta, M, Lutz, W.E, Kumar, S, Natarajan, A, Coates, L, Weiss, K.L, Myles, D.A.A, Kroll, T, Borgstahl, G.E.O.
登録日2024-05-20
公開日2025-03-12
実験手法NEUTRON DIFFRACTION (2.3 Å)
主引用文献The role of Tyr34 in proton coupled electron transfer and product inhibition of manganese superoxide dismutase.
Nat Commun, 16, 2025
9BWQ
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X-ray Counterpart to the Neutron Structure of Peroxide-Soaked Tyr34Phe MnSOD
分子名称: HYDROGEN PEROXIDE, MANGANESE (II) ION, PHOSPHATE ION, ...
著者Azadmanesh, J, Slobodnik, K, Struble, L.R, Cone, E.A, Dasgupta, M, Lutz, W.E, Kumar, S, Natarajan, A, Coates, L, Weiss, K.L, Myles, D.A.A, Kroll, T, Borgstahl, G.E.O.
登録日2024-05-21
公開日2025-03-12
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献The role of Tyr34 in proton coupled electron transfer and product inhibition of manganese superoxide dismutase.
Nat Commun, 16, 2025
9BWR
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X-ray Counterpart to the Neutron Structure of Reduced Tyr34Phe MnSOD
分子名称: MANGANESE (II) ION, PHOSPHATE ION, POTASSIUM ION, ...
著者Azadmanesh, J, Slobodnik, K, Struble, L.R, Cone, E.A, Dasgupta, M, Lutz, W.E, Kumar, S, Natarajan, A, Coates, L, Weiss, K.L, Myles, D.A.A, Kroll, T, Borgstahl, G.E.O.
登録日2024-05-21
公開日2025-03-12
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献The role of Tyr34 in proton coupled electron transfer and product inhibition of manganese superoxide dismutase.
Nat Commun, 16, 2025
9BWM
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Neutron Structure of Oxidized Tyr34Phe MnSOD
分子名称: MANGANESE (II) ION, Superoxide dismutase [Mn], mitochondrial
著者Azadmanesh, J, Slobodnik, K, Struble, L.R, Cone, E.A, Dasgupta, M, Lutz, W.E, Kumar, S, Natarajan, A, Coates, L, Weiss, K.L, Myles, D.A.A, Kroll, T, Borgstahl, G.E.O.
登録日2024-05-21
公開日2025-03-12
実験手法NEUTRON DIFFRACTION (2.28 Å)
主引用文献The role of Tyr34 in proton coupled electron transfer and product inhibition of manganese superoxide dismutase.
Nat Commun, 16, 2025
9BW2
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Neutron Structure of Reduced Tyr34Phe MnSOD
分子名称: MANGANESE (II) ION, Superoxide dismutase [Mn], mitochondrial
著者Azadmanesh, J, Slobodnik, K, Struble, L.R, Cone, E.A, Dasgupta, M, Lutz, W.E, Kumar, S, Natarajan, A, Coates, L, Weiss, K.L, Myles, D.A.A, Kroll, T, Borgstahl, G.E.O.
登録日2024-05-20
公開日2025-03-12
実験手法NEUTRON DIFFRACTION (2.5 Å)
主引用文献The role of Tyr34 in proton coupled electron transfer and product inhibition of manganese superoxide dismutase.
Nat Commun, 16, 2025
4FBY
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BU of 4fby by Molmil
fs X-ray diffraction of Photosystem II
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Kern, J, Alonso-Mori, R, Hellmich, J, Tran, R, Hattne, J, Laksmono, H, Gloeckner, C, Echols, N, Sierra, R.G, Sellberg, J, Lassalle-Kaiser, B, Gildea, R.J, Glatzel, P, Grosse-Kunstleve, R.W, Latimer, M.J, Mcqueen, T.A, Difiore, D, Fry, A.R, Messerschmidt, M.M, Miahnahri, A, Schafer, D.W, Seibert, M.M, Sokaras, D, Weng, T.-C, Zwart, P.H, White, W.E, Adams, P.D, Bogan, M.J, Boutet, S, Williams, G.J, Messinger, J, Sauter, N.K, Zouni, A, Bergmann, U, Yano, J, Yachandra, V.K.
登録日2012-05-23
公開日2012-06-20
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (6.56 Å)
主引用文献Room temperature femtosecond X-ray diffraction of photosystem II microcrystals.
Proc.Natl.Acad.Sci.USA, 109, 2012
6NS5
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BU of 6ns5 by Molmil
Crystal structure of fungal lipoxygenase from Fusarium graminearum. Second C2 crystal form.
分子名称: FE (II) ION, lipoxygenase
著者Pakhomova, S, Boeglin, W.E, Neau, D.B, Bartlett, S.G, Brash, A.R, Newcomer, M.E.
登録日2019-01-24
公開日2019-03-27
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.79 Å)
主引用文献An ensemble of lipoxygenase structures reveals novel conformations of the Fe coordination sphere.
Protein Sci., 28, 2019
9B2G
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Crystal structure of short chain dehydrogenase reductase 9 (short chain dehydrogenase reductase 9C4) in complex with NADH
分子名称: 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, Dehydrogenase/reductase SDR family member 9
著者Pakhomova, S, Belyaeva, O.V, Boeglin, W.E, Kedishvili, N.Y, Brash, A.R, Newcomer, M.E, Popov, K.M.
登録日2024-03-15
公開日2025-03-19
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献The large substrate binding pocket of dehydrogenase reductase 9 underlies its ability to oxidize diverse pro-inflammatory and pro-resolving oxylipins.
To Be Published
9B2F
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Crystal structure of short chain dehydrogenase reductase 9 (short chain dehydrogenase reductase 9C4) in complex with NAD+
分子名称: Dehydrogenase/reductase SDR family member 9, MALONATE ION, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
著者Pakhomova, S, Belyaeva, O.V, Boeglin, W.E, Kedishvili, N.Y, Brash, A.R, Newcomer, M.E, Popov, K.M.
登録日2024-03-15
公開日2025-03-19
実験手法X-RAY DIFFRACTION (1.662 Å)
主引用文献The large substrate binding pocket of dehydrogenase reductase 9 underlies its ability to oxidize diverse pro-inflammatory and pro-resolving oxylipins.
To Be Published
6NS2
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Crystal structure of fungal lipoxygenase from Fusarium graminearum. P212121 crystal form.
分子名称: FE (II) ION, lipoxygenase
著者Pakhomova, S, Boeglin, W.E, Neau, D.B, Bartlett, S.G, Brash, A.R, Newcomer, M.E.
登録日2019-01-24
公開日2019-03-27
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.79 Å)
主引用文献An ensemble of lipoxygenase structures reveals novel conformations of the Fe coordination sphere.
Protein Sci., 28, 2019
6NS3
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Crystal structure of fungal lipoxygenase from Fusarium graminearum. I222 crystal form.
分子名称: FE (II) ION, lipoxygenase
著者Pakhomova, S, Boeglin, W.E, Neau, D.B, Bartlett, S.G, Brash, A.R, Newcomer, M.E.
登録日2019-01-24
公開日2019-03-27
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.84 Å)
主引用文献An ensemble of lipoxygenase structures reveals novel conformations of the Fe coordination sphere.
Protein Sci., 28, 2019
6NS4
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Crystal structure of fungal lipoxygenase from Fusarium graminearum. C2 crystal form.
分子名称: ACETATE ION, FE (II) ION, GLYCEROL, ...
著者Pakhomova, S, Boeglin, W.E, Neau, D.B, Bartlett, S.G, Brash, A.R, Newcomer, M.E.
登録日2019-01-24
公開日2019-03-27
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献An ensemble of lipoxygenase structures reveals novel conformations of the Fe coordination sphere.
Protein Sci., 28, 2019
6NS6
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BU of 6ns6 by Molmil
Crystal structure of fungal lipoxygenase from Fusarium graminearum. P21 crystal form.
分子名称: FE (II) ION, lipoxygenase
著者Pakhomova, S, Boeglin, W.E, Neau, D.B, Bartlett, S.G, Brash, A.R, Newcomer, M.E.
登録日2019-01-24
公開日2019-03-27
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (3.3 Å)
主引用文献An ensemble of lipoxygenase structures reveals novel conformations of the Fe coordination sphere.
Protein Sci., 28, 2019
4H7B
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BU of 4h7b by Molmil
Crystal Structure of Staphylococcal nuclease mutant I72V/V99L
分子名称: Thermonuclease
著者Sanders, J.M, Janowska, K, Sakon, J, Stites, W.E.
登録日2012-09-20
公開日2012-10-17
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Hydrophobic core mutants of Staphylococcal nuclease
To be Published
1NWI
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BU of 1nwi by Molmil
Crystal structure of CO-HbI transformed to an unligated state
分子名称: PROTOPORPHYRIN IX CONTAINING FE, globin I
著者Knapp, J.E, Royer JR, W.E.
登録日2003-02-06
公開日2003-08-26
最終更新日2023-08-16
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Ligand-linked structural transitions in crystals of a cooperative dimeric hemoglobin.
Biochemistry, 42, 2003
1NWN
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Crystals of CO-HbI in which the structure was converted to its unligated state, and then converted back to its original CO-ligated state.
分子名称: CARBON MONOXIDE, PROTOPORPHYRIN IX CONTAINING FE, globin I
著者Knapp, J.E, Royer JR, W.E.
登録日2003-02-06
公開日2003-08-26
最終更新日2023-08-16
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Ligand-linked structural transitions in crystals of a cooperative dimeric hemoglobin.
Biochemistry, 42, 2003
1J6X
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CRYSTAL STRUCTURE OF HELICOBACTER PYLORI LUXS
分子名称: AUTOINDUCER-2 PRODUCTION PROTEIN LUXS, METHIONINE, ZINC ION
著者Lewis, H.A, Furlong, E.B, Bergseid, M.G, Sanderson, W.E, Buchanan, S.G.
登録日2001-05-14
公開日2001-06-08
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (2.38 Å)
主引用文献A structural genomics approach to the study of quorum sensing: crystal structures of three LuxS orthologs.
Structure, 9, 2001
1J6W
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BU of 1j6w by Molmil
CRYSTAL STRUCTURE OF HAEMOPHILUS INFLUENZAE LUXS
分子名称: AUTOINDUCER-2 PRODUCTION PROTEIN LUXS, METHIONINE, ZINC ION
著者Lewis, H.A, Furlong, E.B, Bergseid, M.G, Sanderson, W.E, Buchanan, S.G.
登録日2001-05-14
公開日2001-06-08
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献A structural genomics approach to the study of quorum sensing: crystal structures of three LuxS orthologs.
Structure, 9, 2001
1INN
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CRYSTAL STRUCTURE OF D. RADIODURANS LUXS, P21
分子名称: AUTOINDUCER-2 PRODUCTION PROTEIN LUXS, METHIONINE, ZINC ION
著者Lewis, H.A, Furlong, E.B, Bergseid, M.G, Sanderson, W.E, Buchanan, S.G.
登録日2001-05-14
公開日2001-06-08
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献A structural genomics approach to the study of quorum sensing: crystal structures of three LuxS orthologs.
Structure, 9, 2001
1GND
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GUANINE NUCLEOTIDE DISSOCIATION INHIBITOR, ALPHA-ISOFORM
分子名称: GUANINE NUCLEOTIDE DISSOCIATION INHIBITOR
著者Schalk, I, Zeng, K, Wu, S.-K, Stura, E.A, Metteson, J, Huang, M, Tandon, A, Wilson, I.A, Balch, W.E.
登録日1996-07-10
公開日1997-02-12
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.81 Å)
主引用文献Structure and mutational analysis of Rab GDP-dissociation inhibitor.
Nature, 381, 1996
1J6V
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BU of 1j6v by Molmil
CRYSTAL STRUCTURE OF D. RADIODURANS LUXS, C2
分子名称: AUTOINDUCER-2 PRODUCTION PROTEIN LUXS, ZINC ION
著者Lewis, H.A, Furlong, E.B, Bergseid, M.G, Sanderson, W.E, Buchanan, S.G.
登録日2001-05-14
公開日2001-06-08
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献A structural genomics approach to the study of quorum sensing: crystal structures of three LuxS orthologs.
Structure, 9, 2001
5JRN
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BU of 5jrn by Molmil
Crystal Structure of a Xylanase in Complex with a Monosaccharide at 2.84 Angstroem resolution
分子名称: Endo-1,4-beta-xylanase, GLYCEROL, methyl beta-D-xylopyranoside
著者Gomez, S, Payne, A.M, Savko, M, Fox, G.C, Shepard, W.E, Fernandez, F.J, Vega, M.C.
登録日2016-05-06
公開日2017-05-24
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (2.841 Å)
主引用文献Structural and functional characterization of a highly stable endo-beta-1,4-xylanase from Fusarium oxysporum and its development as an efficient immobilized biocatalyst.
Biotechnol Biofuels, 9, 2016

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