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7MHP
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BU of 7mhp by Molmil
Ensemble refinement structure of SARS-CoV-2 main protease (Mpro) at 298 K at high humidity
分子名称: 3C-like proteinase, ZINC ION
著者Ebrahim, A, Riley, B.T, Kumaran, D, Andi, B, Fuchs, M.R, McSweeney, S, Keedy, D.A.
登録日2021-04-15
公開日2021-05-12
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.0005 Å)
主引用文献The temperature-dependent conformational ensemble of SARS-CoV-2 main protease (M pro )
Iucrj, 9, 2022
7MRR
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BU of 7mrr by Molmil
Crystal Structure of SARS-CoV-2 Main Protease (3CLpro/Mpro) in Complex with Covalent Inhibitor Leupeptin
分子名称: 3C-like proteinase, DIMETHYL SULFOXIDE, LEUPEPTIN
著者Andi, B, Kumaran, D, Soares, A.S, Kreitler, D.F, Shi, W, Jakoncic, J, Fuchs, M.R, Keereetaweep, J, Shanklin, J, McSweeney, S.
登録日2021-05-08
公開日2021-05-19
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.32 Å)
主引用文献Hepatitis C virus NS3/4A inhibitors and other drug-like compounds as covalent binders of SARS-CoV-2 main protease.
Sci Rep, 12, 2022
2OGJ
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BU of 2ogj by Molmil
Crystal structure of a dihydroorotase
分子名称: Dihydroorotase, IMIDAZOLE, ZINC ION
著者Sugadev, R, Kumaran, D, Burley, S.K, Swaminathan, S, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2007-01-05
公開日2007-02-20
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (2.62 Å)
主引用文献Crystal structure of a dihydroorotase
To be Published
2QVC
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BU of 2qvc by Molmil
Crystal structure of a periplasmic sugar ABC transporter from Thermotoga maritima
分子名称: Sugar ABC transporter, periplasmic sugar-binding protein, beta-D-glucopyranose
著者Palani, K, Kumaran, D, Burley, S.K, Swaminathan, S, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2007-08-08
公開日2007-08-28
最終更新日2021-02-03
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structure of a periplasmic glucose-binding protein from Thermotoga maritima.
Acta Crystallogr.,Sect.F, 68, 2012
2GU1
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BU of 2gu1 by Molmil
Crystal structure of a zinc containing peptidase from vibrio cholerae
分子名称: SODIUM ION, ZINC ION, Zinc peptidase
著者Sugadev, R, Kumaran, D, Swaminathan, S, Burley, S.K, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2006-04-28
公開日2006-07-04
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Crystal structure of a putative lysostaphin peptidase from Vibrio cholerae.
Proteins, 72, 2008
2GOK
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BU of 2gok by Molmil
Crystal structure of the imidazolonepropionase from Agrobacterium tumefaciens at 1.87 A resolution
分子名称: CHLORIDE ION, FE (III) ION, GLYCEROL, ...
著者Tyagi, R, Kumaran, D, Swaminathan, S, Burley, S.K, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2006-04-13
公開日2006-04-25
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (1.87 Å)
主引用文献X-ray structure of imidazolonepropionase from Agrobacterium tumefaciens at 1.87 A resolution.
Proteins, 69, 2007
2ICS
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BU of 2ics by Molmil
Crystal structure of an adenine deaminase
分子名称: ADENINE, Adenine Deaminase, ZINC ION
著者Sugadev, R, Kumaran, D, Burley, S.K, Swaminathan, S, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2006-09-13
公開日2006-10-17
最終更新日2021-02-03
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Crystal structure of an adenine deaminase
TO BE PUBLISHED
2HAF
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BU of 2haf by Molmil
Crystal structure of a putative translation repressor from Vibrio cholerae
分子名称: Putative translation repressor
著者Sugadev, R, Seetharaman, J, Kumaran, D, Swaminathan, S, Burley, S.K, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2006-06-12
公開日2006-07-04
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.88 Å)
主引用文献Crystal structure of a putative translation repressor from Vibrio cholerae
To be Published
1U02
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BU of 1u02 by Molmil
Crystal structure of trehalose-6-phosphate phosphatase related protein
分子名称: GLYCEROL, MAGNESIUM ION, SODIUM ION, ...
著者Krishnamurthy, N.R, Kumaran, D, Swaminathan, S, Burley, S.K, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2004-07-12
公開日2004-07-20
最終更新日2021-02-03
実験手法X-RAY DIFFRACTION (1.92 Å)
主引用文献Crystal structure of trehalose-6-phosphate phosphatase-related protein: biochemical and biological implications.
Protein Sci., 15, 2006
1S0F
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BU of 1s0f by Molmil
Crystal structure of botulinum neurotoxin type B at pH 7.0
分子名称: Botulinum neurotoxin type B, CALCIUM ION, ZINC ION
著者Eswaramoorthy, S, Kumaran, D, Keller, J, Swaminathan, S.
登録日2003-12-30
公開日2004-03-16
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Role of metals in the biological activity of Clostridium botulinum neurotoxins
Biochemistry, 43, 2004
1S0E
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BU of 1s0e by Molmil
Crystal structure of botulinum neurotoxin type B at pH 6.0
分子名称: Botulinum neurotoxin type B, CALCIUM ION, ZINC ION
著者Eswaramoorthy, S, Kumaran, D, Keller, J, Swaminathan, S.
登録日2003-12-30
公開日2004-03-16
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Role of metals in the biological activity of Clostridium botulinum neurotoxins
Biochemistry, 43, 2004
1S0B
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BU of 1s0b by Molmil
Crystal structure of botulinum neurotoxin type B at pH 4.0
分子名称: Botulinum neurotoxin type B, CALCIUM ION
著者Eswaramoorthy, S, Kumaran, D, Keller, J, Swaminathan, S.
登録日2003-12-30
公開日2004-03-16
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Role of metals in the biological activity of Clostridium botulinum neurotoxins
Biochemistry, 43, 2004
1S0D
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BU of 1s0d by Molmil
Crystal structure of botulinum neurotoxin type B at pH 5.5
分子名称: Botulinum neurotoxin type B, CALCIUM ION, ZINC ION
著者Eswaramoorthy, S, Kumaran, D, Keller, J, Swaminathan, S.
登録日2003-12-30
公開日2004-03-16
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Role of metals in the biological activity of Clostridium botulinum neurotoxins
Biochemistry, 43, 2004
1S0G
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BU of 1s0g by Molmil
Crystal structure of botulinum neurotoxin type B apo form
分子名称: Botulinum neurotoxin type B
著者Eswaramoorthy, S, Kumaran, D, Keller, J, Swaminathan, S.
登録日2003-12-30
公開日2004-03-16
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Role of metals in the biological activity of Clostridium botulinum neurotoxins
Biochemistry, 43, 2004
1S0C
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BU of 1s0c by Molmil
Crystal structure of botulinum neurotoxin type B at pH 5.0
分子名称: Botulinum neurotoxin type B, CALCIUM ION, ZINC ION
著者Eswaramoorthy, S, Kumaran, D, Keller, J, Swaminathan, S.
登録日2003-12-30
公開日2004-03-16
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Role of metals in the biological activity of Clostridium botulinum neurotoxins
Biochemistry, 43, 2004
1T3C
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BU of 1t3c by Molmil
Clostridium botulinum type E catalytic domain E212Q mutant
分子名称: CHLORIDE ION, ZINC ION, neurotoxin type E
著者Agarwal, R, Eswaramoorthy, S, Kumaran, D, Binz, T, Swaminathan, S.
登録日2004-04-26
公開日2004-06-29
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structural analysis of botulinum neurotoxin type E catalytic domain and its mutant Glu212-->Gln reveals the pivotal role of the Glu212 carboxylate in the catalytic pathway
Biochemistry, 43, 2004
1TH4
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BU of 1th4 by Molmil
crystal structure of NADPH depleted bovine liver catalase complexed with 3-amino-1,2,4-triazole
分子名称: 3-AMINO-1,2,4-TRIAZOLE, Catalase, PROTOPORPHYRIN IX CONTAINING FE
著者Sugadev, R, Ponnuswamy, M.N, Kumaran, D, Swaminathan, S, Sekar, K.
登録日2004-06-01
公開日2005-07-05
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.98 Å)
主引用文献crystal structure of bovine liver catalase
TO BE PUBLISHED
1T3A
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BU of 1t3a by Molmil
Crystal structure of Clostridium botulinum neurotoxin type E catalytic domain
分子名称: CHLORIDE ION, ZINC ION, neurotoxin type E
著者Agarwal, R, Eswaramoorthy, S, Kumaran, D, Binz, T, Swaminathan, S.
登録日2004-04-26
公開日2004-06-29
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.16 Å)
主引用文献Structural analysis of botulinum neurotoxin type E catalytic domain and its mutant Glu212-->Gln reveals the pivotal role of the Glu212 carboxylate in the catalytic pathway
Biochemistry, 43, 2004
1GGQ
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BU of 1ggq by Molmil
OUTER SURFACE PROTEIN C (OSPC) OF BORRELIA BURGDORFERI STRAIN B31
分子名称: MAGNESIUM ION, OUTER SURFACE PROTEIN C
著者Dunn, J.J, Lawson, C.L.
登録日2000-09-14
公開日2001-03-14
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2.51 Å)
主引用文献Crystal structure of outer surface protein C (OspC) from the Lyme disease spirochete, Borrelia burgdorferi.
EMBO J., 20, 2001
1I4X
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BU of 1i4x by Molmil
STAPHYLOCOCCAL ENTEROTOXIN C2, MONOCLINIC FORM CRYSTALLIZED AT PH 8.0
分子名称: ENTEROTOXIN TYPE C-2, ZINC ION
著者Swaminathan, S, Sax, M.
登録日2001-02-23
公開日2001-03-14
最終更新日2023-08-09
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structure of staphylococcal enterotoxin C2 at various pH levels.
Acta Crystallogr.,Sect.D, 57, 2001
2QJC
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BU of 2qjc by Molmil
Crystal structure of a putative diadenosine tetraphosphatase
分子名称: Diadenosine tetraphosphatase, putative, MANGANESE (II) ION, ...
著者Sugadev, R, Burley, S.K, Swaminathan, S, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2007-07-06
公開日2007-07-24
最終更新日2021-02-03
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Structural genomics of protein phosphatases.
J.Struct.Funct.Genom., 8, 2007
3C6B
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BU of 3c6b by Molmil
Reaction product of paraoxon and S-formylglutathione hydrolase W197I mutant
分子名称: S-formylglutathione hydrolase
著者Legler, P.M, Millard, C.B.
登録日2008-02-04
公開日2008-08-12
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.17 Å)
主引用文献Structural characterization and reversal of the natural organophosphate resistance of a D-type esterase, Saccharomyces cerevisiae S-formylglutathione hydrolase.
Biochemistry, 47, 2008
2FH7
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BU of 2fh7 by Molmil
Crystal structure of the phosphatase domains of human PTP SIGMA
分子名称: Receptor-type tyrosine-protein phosphatase S
著者Alvarado, J, Udupi, R, Smith, D, Koss, J, Wasserman, S.R, Ozyurt, S, Atwell, S, Powell, A, Kearins, M.C, Rooney, I, Maletic, M, Bain, K.T, Freeman, J.C, Russell, M, Thompson, D.A, Sauder, J.M, Burley, S.K, Almo, S.C, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2005-12-23
公開日2006-01-10
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structural genomics of protein phosphatases.
J.STRUCT.FUNCT.GENOM., 8, 2007
8EUA
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BU of 8eua by Molmil
Structure of SARS-CoV2 PLpro bound to a covalent inhibitor
分子名称: Papain-like protease nsp3, SULFATE ION, ZINC ION, ...
著者Mathews, I.I, Pokhrel, S, Wakatsuki, S.
登録日2022-10-18
公開日2023-04-05
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献Potent and selective covalent inhibition of the papain-like protease from SARS-CoV-2.
Nat Commun, 14, 2023
1KHI
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BU of 1khi by Molmil
CRYSTAL STRUCTURE OF HEX1
分子名称: Hex1
著者Yuan, P, Swaminathan, K.
登録日2001-11-30
公開日2002-11-30
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (1.78 Å)
主引用文献A HEX-1 crystal lattice required for Woronin body function in Neurospora crassa
NAT.STRUCT.BIOL., 10, 2003

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