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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
7K3T
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BU of 7k3t by Molmil
Crystal Structure of SARS-CoV-2 Main Protease (3CLpro/Mpro) at 1.2 A Resolution and a Possible Capture of Zinc Binding Intermediate
分子名称: 3C-like proteinase, DIMETHYL SULFOXIDE, ZINC ION
著者Andi, B, Kumaran, D, Kreitler, D.F, Soares, A.S, Shi, W, Jakoncic, J, Fuchs, M.R, Keereetaweep, J, Shanklin, J, McSweeney, S.
登録日2020-09-13
公開日2020-09-23
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.2 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
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
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
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
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
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
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
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
2QXY
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BU of 2qxy by Molmil
Crystal structure of a response regulator from Thermotoga maritima
分子名称: Response regulator, SULFATE ION
著者Palani, K, Kumaran, D, Burley, S.K, Swaminathan, S, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2007-08-13
公開日2007-08-28
最終更新日2021-02-03
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Crystal structure of a response regulator from Thermotoga maritima.
To be Published
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
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
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
1XN9
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BU of 1xn9 by Molmil
Solution Structure of Methanosarcina mazei Protein RPS24E: The Northeast Structural Genomics Consortium Target MaR11
分子名称: 30S ribosomal protein S24e
著者Liu, G, Xiao, R, Parish, D, Ma, L, Sukumaran, D, Acton, T, Montelione, G.T, Szyperski, T, Northeast Structural Genomics Consortium (NESG)
登録日2004-10-04
公開日2004-12-14
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Solution Structure of Methanosarcina mazei Protein RPS24E: The Northeast Structural Genomics Consortium Target MaR11
To be Published
2MRA
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BU of 2mra by Molmil
Solution NMR Structure of De novo designed protein, Northeast Structural Genomics Consortium (NESG) Target OR459
分子名称: De novo designed protein OR459
著者Pulavarti, S.V.S.R.K, Kipnis, Y, Sukumaran, D, Maglaqui, M, Janjua, H, Mao, L, Xiao, R, Kornhaber, G, Baker, D, Montelione, G.T, Szyperski, T, Northeast Structural Genomics Consortium (NESG)
登録日2014-07-02
公開日2014-09-17
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Solution NMR Structure of De novo designed protein, Northeast Structural Genomics Consortium (NESG) Target OR459
To be Published
2JPU
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BU of 2jpu by Molmil
solution structure of NESG target SsR10, Orf c02003 protein
分子名称: Orf c02003 protein
著者Wu, Y, Singarapu, K.K, Zhang, Q, Eletski, A, Xu, D, Sukumaran, D, Parish, D, Wang, D, Jiang, M, Cunningham, K, Maglaqui, M, Owens, L, Xiao, R, Liu, J, Baran, M, Swapna, G.V.T, Acton, T, Rost, B, Montelione, G, Szyperski, T, Northeast Structural Genomics Consortium (NESG)
登録日2007-05-23
公開日2007-07-03
最終更新日2024-05-08
実験手法SOLUTION NMR
主引用文献Solution structure of NESG target SsR10, Orf c02003 protein
To be Published
2HG7
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BU of 2hg7 by Molmil
Solution NMR structure of Phage-like element PBSX protein xkdW, Northeast Structural Genomics Consortium Target SR355
分子名称: Phage-like element PBSX protein xkdW
著者Liu, G, Parish, D, Xu, D, Atreya, H, Sukumaran, D, Ho, C.K, Jiang, M, Cunningham, K, Ma, L.-C, Xiao, R, Liu, J, Baran, M, Swapna, G.V, Acton, T.B, Rost, B, Montelione, G.T, Szyperski, T, Northeast Structural Genomics Consortium (NESG)
登録日2006-06-26
公開日2006-08-22
最終更新日2024-05-29
実験手法SOLUTION NMR
主引用文献Solution NMR structure of Phage-like element PBSX protein xkdW, Northeast Structural Genomics Consortium Target SR355
TO BE PUBLISHED
2JVM
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BU of 2jvm by Molmil
Solution NMR structure of Rhodobacter sphaeroides protein RHOS4_26430. Northeast Structural Genomics Consortium target RhR95
分子名称: Uncharacterized protein
著者Eletsky, A, Sukumaran, D, Zhang, Q, Parish, D, Xu, D, Wang, H, Janjua, H, Owens, L, Xiao, R, Liu, J, Baran, M.C, Swapna, G.V.T, Acton, T.B, Rost, B, Montelione, G.T, Szyperski, T, Northeast Structural Genomics Consortium (NESG)
登録日2007-09-21
公開日2007-10-16
最終更新日2024-05-29
実験手法SOLUTION NMR
主引用文献Solution NMR Structure of Rhodobacter sphaeroides protein RHOS4_26430.
To be Published
2JY9
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BU of 2jy9 by Molmil
NMR structure of putative tRNA hydrolase domain from Salmonella typhimurium. NorthEast Structural Genomics Consortium target StR220
分子名称: Putative tRNA hydrolase domain
著者Singarapu, K.K, Wu, Y, Sukumaran, D, Eletsky, A, Zeri, A, Wang, D, Janjua, H, Owens, L, Xiao, R, Liu, J, Baran, M.C, Swapna, G.V.T, Acton, T.B, Rost, B, Montelione, G.T, Szyperski, T, Northeast Structural Genomics Consortium (NESG)
登録日2007-12-07
公開日2008-01-01
最終更新日2024-05-08
実験手法SOLUTION NMR
主引用文献NMR structure of putative tRNA hydrolase domain from Salmonella typhimurium.
To be Published
2JNA
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BU of 2jna by Molmil
Solution NMR Structure of Salmonella typhimurium LT2 Secreted Protein STM0082: Northeast Structural Genomics Consortium Target StR109
分子名称: Putative secreted protein
著者Eletsky, A, Parish, D, Liu, G, Sukumaran, D, Jiang, M, Cunningham, K, Ma, L, Xiao, R, Rost, B, Montelione, G.T, Szyperski, T, Northeast Structural Genomics Consortium (NESG)
登録日2006-12-31
公開日2007-02-06
最終更新日2023-12-20
実験手法SOLUTION NMR
主引用文献Solution NMR Structure of Salmonella typhimurium LT2 Secreted Protein STM0082: Northeast Structural Genomics Consortium Target StR109
To be Published

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