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2JS5
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BU of 2js5 by Molmil
NMR Structure of protein Q60C73_METCA. Northeast Structural Genomics Consortium target McR1
分子名称: Uncharacterized protein
著者Singarapu, K.K, Wu, Y, Eletsky, A, Sukumaran, D, Parish, D, Chen, C.X, Nwosu, C, Maglaqui, M, 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2007-06-29
公開日2007-07-31
最終更新日2024-05-08
実験手法SOLUTION NMR
主引用文献NMR Structure of protein Q60C73_METCA.
To be Published
2KPJ
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BU of 2kpj by Molmil
Solution Structure Of Protein SOS-response transcriptional repressor, LexA From Eubacterium rectale. Northeast Structural Genomics Consortium Target ErR9A
分子名称: SOS-response transcriptional repressor, LexA
著者Wu, Y, Eletsky, A, Lee, D, Ghosh, A, Buchwald, W, Zhang, Q, Janjua, H, Garcia, E, Nair, R, Sukumaran, D, Rost, B, Acton, T, Xiao, R, Everett, J, Montelione, G.T, Szyperski, T, Northeast Structural Genomics Consortium (NESG)
登録日2009-10-16
公開日2009-11-17
最終更新日2024-05-08
実験手法SOLUTION NMR
主引用文献Solution Structure Of Protein SOS-response transcriptional repressor, LexA From Eubacterium rectale. Northeast Structural Genomics Consortium Target ErR9A
To be Published
2K5G
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BU of 2k5g by Molmil
Solution NMR structure of protein encoded by gene BPP1335 from Bordetella parapertussis: Northeast Structural Genomics Target BpR195
分子名称: uncharacterized protein
著者Singarapu, K, Eletsky, A, Sathyamoorthy, B, Sukumaran, D, Wang, D, Jiang, M, Ciccosanti, C, Xiao, R, Liu, J, Baran, M.C, Swapna, G, Acton, T.B, Rost, B, Montelione, G.T, Szyperski, T, Northeast Structural Genomics Consortium (NESG)
登録日2008-06-27
公開日2008-09-02
最終更新日2024-05-08
実験手法SOLUTION NMR
主引用文献Solution NMR structure of protein encoded by gene BPP1335 from Bordetella parapertussis: Northeast Structural Genomics Target BpR195
To be Published
2KAT
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BU of 2kat by Molmil
Solution structure of protein BPP2914 from Bordetella parapertussis. Northeast Structural Genomics Consortium target BpR206
分子名称: uncharacterized protein
著者Wu, Y, Mills, J.L, Wang, D, Jiang, M, Foote, E.L, Xiao, R, Sathyamoorthy, B, Sukumaran, D, Nair, R, Everett, J.K, Swapna, G, Acton, T.B, Rost, B, Montelione, G.T, Szyperski, T, Northeast Structural Genomics Consortium (NESG)
登録日2008-11-14
公開日2008-12-16
最終更新日2024-05-08
実験手法SOLUTION NMR
主引用文献Solution structure of protein BPP2914 from Bordetella parapertussis. Northeast Structural Genomics Consortium target BpR206
To be Published
1NKQ
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BU of 1nkq by Molmil
Crystal structure of yeast ynq8, a fumarylacetoacetate hydrolase family protein
分子名称: ACETIC ACID, CALCIUM ION, Hypothetical 28.8 kDa protein in PSD1-SKO1 intergenic region, ...
著者Eswaramoorthy, S, Kumaran, D, Daniels, B, Studier, F.W, Swaminathan, S, Burley, S.K, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2003-01-03
公開日2004-06-15
最終更新日2021-02-03
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Crtystal Structure of Yeast Hypothetical Protein YNQ8_YEAST
To be Published
2F1R
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BU of 2f1r by Molmil
Crystal Structure of molybdopterin-guanine biosynthesis protein B (mobB)
分子名称: CHLORIDE ION, PRASEODYMIUM ION, molybdopterin-guanine dinucleotide biosynthesis protein B (mobB)
著者Damodharan, L, Eswaramoorthy, S, Kumaran, D, Swaminathan, S, Burley, S.K, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2005-11-15
公開日2005-12-06
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Crystal structure of molybdopterin-guanine dinucleotide biosynthesis protein B (mobB)
To be Published
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
2RHD
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BU of 2rhd by Molmil
Crystal structure of Cryptosporidium parvum small GTPase RAB1A
分子名称: GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, Small GTP binding protein rab1a
著者Dong, A, Xu, X, Lew, J, Lin, Y.H, Khuu, C, Sun, X, Qiu, W, Kozieradzki, I, Arrowsmith, C.H, Edwards, A.M, Weigelt, J, Sundstrom, M, Bochkarev, A, Hui, R, Sukumar, D, Structural Genomics Consortium (SGC)
登録日2007-10-09
公開日2007-10-23
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.06 Å)
主引用文献Crystal structure of Cryptosporidium parvum small GTPase RAB1A.
To be Published
1I1E
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BU of 1i1e by Molmil
CRYSTAL STRUCTURE OF CLOSTRIDIUM BOTULINUM NEUROTOXIN B COMPLEXED WITH DOXORUBICIN
分子名称: BOTULINUM NEUROTOXIN TYPE B, DOXORUBICIN, SULFATE ION, ...
著者Eswaramoorthy, S, Kumaran, D, Swaminathan, S.
登録日2001-02-01
公開日2001-11-21
最終更新日2023-08-09
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Crystallographic evidence for doxorubicin binding to the receptor-binding site in Clostridium botulinum neurotoxin B.
Acta Crystallogr.,Sect.D, 57, 2001
2UW1
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BU of 2uw1 by Molmil
Ivy Desaturase Structure
分子名称: (3R)-3-HYDROXY-5,5-DIMETHYLHEXANOIC ACID, FE (III) ION, PLASTID DELTA4 MULTIFUNCTIONAL ACYL-ACYL CARRIER PROTEIN DESATURASE, ...
著者Guy, J.E, Whittle, E, Kumaran, D, Lindqvist, Y, Shanklin, J.
登録日2007-03-15
公開日2007-05-08
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献The Crystal Structure of the Ivy {Delta}4-16:0-Acp Desaturase Reveals Structural Details of the Oxidized Active Site and Potential Determinants of Regioselectivity.
J.Biol.Chem., 282, 2007
3BFK
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BU of 3bfk by Molmil
Crystal structure of Plasmodium falciparum Rab11a in complex with GDP
分子名称: GLYCEROL, GUANOSINE-5'-DIPHOSPHATE, Small GTPase Rab11
著者Pizarro, J.C, Sukumar, D, Hassanali, A, Lin, L, Wernimont, A.K, Lew, J, Kozieradzki, I, Edwards, A.M, Arrowsmith, C.H, Weigelt, J, Sundstrom, M, Bochkarev, A, Hui, R, Structural Genomics Consortium (SGC)
登録日2007-11-21
公開日2007-12-04
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal structure of Plasmodium falciparum Rab11a in complex with GDP.
To be Published
3BCV
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BU of 3bcv by Molmil
Crystal structure of a putative glycosyltransferase from Bacteroides fragilis
分子名称: Putative glycosyltransferase protein
著者Palani, K, Kumaran, D, Burley, S.K, Swaminathan, S, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2007-11-13
公開日2007-11-27
最終更新日2021-02-03
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Crystal structure of a putative glycosyltransferase from Bacteroides fragilis.
To be Published
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
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2024-10-09
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
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
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
7MHN
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BU of 7mhn by Molmil
Ensemble refinement structure of SARS-CoV-2 main protease (Mpro) at 277 K
分子名称: 3C-like proteinase, DIMETHYL SULFOXIDE, 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 (2.1908 Å)
主引用文献The temperature-dependent conformational ensemble of SARS-CoV-2 main protease (M pro )
Iucrj, 9, 2022
7MHJ
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BU of 7mhj by Molmil
Crystal Structure of SARS-CoV-2 Main Protease (Mpro) at 298 K and 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 tem-per-ature-dependent conformational ensemble of SARS-CoV-2 main protease (M pro ).
Iucrj, 9, 2022
7MHO
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BU of 7mho by Molmil
Ensemble refinement structure of SARS-CoV-2 main protease (Mpro) at 298 K
分子名称: 3C-like proteinase, DIMETHYL SULFOXIDE, 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 (1.88 Å)
主引用文献The temperature-dependent conformational ensemble of SARS-CoV-2 main protease (M pro )
Iucrj, 9, 2022
7MHK
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BU of 7mhk by Molmil
Crystal Structure of Apo/Unliganded SARS-CoV-2 Main Protease (Mpro) at 310 K
分子名称: 3C-like proteinase, DIMETHYL SULFOXIDE, 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 (1.9601 Å)
主引用文献The tem-per-ature-dependent conformational ensemble of SARS-CoV-2 main protease (M pro ).
Iucrj, 9, 2022
7MNG
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BU of 7mng by Molmil
Crystal Structure of SARS-CoV-2 Main Protease (3CLpro/Mpro) in Complex with Covalent Inhibitor VBY-825 (Partial Occupancy)
分子名称: (2R,3S)-N-cyclopropyl-3-{[(2R)-3-(cyclopropylmethanesulfonyl)-2-{[(1S)-2,2,2-trifluoro-1-(4-fluorophenyl)ethyl]amino}propanoyl]amino}-2-hydroxypentanamide (non-preferred name), 3C-like proteinase, DIMETHYL SULFOXIDE
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2021-04-30
公開日2021-05-12
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.7 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
7MHI
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BU of 7mhi by Molmil
Crystal Structure of SARS-CoV-2 Main Protease (Mpro) at 298 K
分子名称: 3C-like proteinase, DIMETHYL SULFOXIDE, 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 (1.88 Å)
主引用文献The tem-per-ature-dependent conformational ensemble of SARS-CoV-2 main protease (M pro ).
Iucrj, 9, 2022

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