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PDB: 1177 件

6YMA
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BU of 6yma by Molmil
MicroED structure of acetazolamide-bound human carbonic anhydrase II
分子名称: 5-ACETAMIDO-1,3,4-THIADIAZOLE-2-SULFONAMIDE, DIMETHYL SULFOXIDE, ZINC ION, ...
著者Clabbers, M.T.B, Fisher, S.Z, Coincon, M, Zou, X, Xu, H.
登録日2020-04-08
公開日2020-08-12
最終更新日2024-01-24
実験手法ELECTRON CRYSTALLOGRAPHY (2.5 Å)
主引用文献Visualizing drug binding interactions using microcrystal electron diffraction.
Commun Biol, 3, 2020
7Z5S
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BU of 7z5s by Molmil
Crystal Structure of botulinum neurotoxin A2 cell binding domain in complex with GD1a
分子名称: 1,2-ETHANEDIOL, Botulinum neurotoxin, HEXAETHYLENE GLYCOL, ...
著者Gregory, K.S, Acharya, K.R, Liu, S.M, Mahadeva, T.B.
登録日2022-03-10
公開日2022-06-08
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structural Features of Clostridium botulinum Neurotoxin Subtype A2 Cell Binding Domain.
Toxins, 14, 2022
7Z5T
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BU of 7z5t by Molmil
Crystal Structure of botulinum neurotoxin A2 cell binding domain
分子名称: ACETATE ION, Botulinum neurotoxin, PENTAETHYLENE GLYCOL
著者Gregory, K.S, Acharya, K.R, Liu, S.M, Mahadeva, T.B.
登録日2022-03-10
公開日2022-06-08
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.63 Å)
主引用文献Structural Features of Clostridium botulinum Neurotoxin Subtype A2 Cell Binding Domain.
Toxins, 14, 2022
7BER
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BU of 7ber by Molmil
SFX structure of the MyD88 TIR domain higher-order assembly (solved, rebuilt and refined using an identical protocol to the MicroED structure of the MyD88 TIR domain higher-order assembly)
分子名称: Myeloid differentiation primary response protein MyD88
著者Clabbers, M.T.B, Holmes, S, Muusse, T.W, Vajjhala, P, Thygesen, S.J, Malde, A.K, Hunter, D.J.B, Croll, T.I, Nanson, J.D, Rahaman, M.H, Aquila, A, Hunter, M.S, Liang, M, Yoon, C.H, Zhao, J, Zatsepin, N.A, Abbey, B, Sierecki, E, Gambin, Y, Darmanin, C, Kobe, B, Xu, H, Ve, T.
登録日2020-12-24
公開日2021-03-10
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献MyD88 TIR domain higher-order assembly interactions revealed by microcrystal electron diffraction and serial femtosecond crystallography.
Nat Commun, 12, 2021
7BEQ
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BU of 7beq by Molmil
MicroED structure of the MyD88 TIR domain higher-order assembly
分子名称: Myeloid differentiation primary response protein MyD88
著者Clabbers, M.T.B, Holmes, S, Muusse, T.W, Vajjhala, P, Thygesen, S.J, Malde, A.K, Hunter, D.J.B, Croll, T.I, Nanson, J.D, Rahaman, M.H, Aquila, A, Hunter, M.S, Liang, M, Yoon, C.H, Zhao, J, Zatsepin, N.A, Abbey, B, Sierecki, E, Gambin, Y, Darmanin, C, Kobe, B, Xu, H, Ve, T.
登録日2020-12-24
公開日2021-03-10
最終更新日2024-01-31
実験手法ELECTRON CRYSTALLOGRAPHY (3 Å)
主引用文献MyD88 TIR domain higher-order assembly interactions revealed by microcrystal electron diffraction and serial femtosecond crystallography.
Nat Commun, 12, 2021
4ILS
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BU of 4ils by Molmil
Crystal structure of engineered protein. northeast structural genomics Consortium target or117
分子名称: Engineered protein
著者Seetharaman, J, Lew, S, Nivon, L, Baker, D, Bjelic, S, Ciccosanti, C, Sahdev, S, Xiao, R, Everett, J.K, Acton, T.B, Montelione, G.T, Tong, L, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
登録日2012-12-31
公開日2013-03-20
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Crystal structure of engineered protein. northeast structural genomics Consortium target or117
To be Published
4IOH
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BU of 4ioh by Molmil
Crystal Structure of the Tll1086 protein from Thermosynechococcus elongatus, Northeast Structural Genomics Consortium Target TeR258
分子名称: Tll1086 protein
著者Vorobiev, S, Su, M, Seetharaman, J, Maglaqui, M, Xiao, X, Kohan, E, Wang, D, Everett, J.K, Acton, T.B, Montelione, G.T, Tong, L, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
登録日2013-01-07
公開日2013-01-30
最終更新日2013-11-20
実験手法X-RAY DIFFRACTION (2.53 Å)
主引用文献Crystal Structure of the Tll1086 protein from Thermosynechococcus elongatus.
To be Published
4IJB
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BU of 4ijb by Molmil
Crystal Structure of Engineered Protein, Northeast Structural Genomics Consortium Target OR288
分子名称: Engineered Protein OR288
著者Vorobiev, S, Su, M, Bick, M.J, Seetharaman, J, Khare, S, Maglaqui, M, Xiao, R, Lee, D, Day, A, Everett, J.K, Acton, T.B, Baker, D, Montelione, G.T, Hunt, J, Tong, L, Northeast Structural Genomics Consortium (NESG)
登録日2012-12-21
公開日2013-01-16
最終更新日2013-02-27
実験手法X-RAY DIFFRACTION (1.739 Å)
主引用文献Crystal Structure of Engineered Protein OR288.
To be Published
4INA
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BU of 4ina by Molmil
Crystal Structure of the Q7MSS8_WOLSU protein from Wolinella succinogenes. Northeast Structural Genomics Consortium Target WsR35
分子名称: saccharopine dehydrogenase
著者Vorobiev, S, Su, M, Seetharaman, J, Maglaqui, M, Xiao, R, Kohan, E, Wang, D, Everett, J.K, Acton, T.B, Montelione, G.T, Tong, L, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
登録日2013-01-04
公開日2013-01-16
最終更新日2013-11-27
実験手法X-RAY DIFFRACTION (2.488 Å)
主引用文献Crystal Structure of the Q7MSS8_WOLSU protein from Wolinella succinogenes.
To be Published
4RIS
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BU of 4ris by Molmil
Structural Analysis of the Unmutated Ancestor of the HIV-1 Envelope V2 Region Antibody CH58 Isolated From an RV144 HIV-1 Vaccine Efficacy Trial Vaccinee and Associated with Decreased Transmission Risk
分子名称: CH58-UA Fab heavy chain, CH58-UA Fab light chain, Envelope glycoprotein
著者Nicely, N.I, Wiehe, K, Kepler, T.B, Jaeger, F.H, Dennison, S.M, Liao, H.-X, Alam, S.M, Hwang, K.-K, Bonsignori, M, Rerks-Ngarm, S, Nitayaphan, S, Pitisuttithum, P, Kaewkungwal, J, Robb, M.L, O'Connell, R.J, Michael, N.L, Kim, J.H, Haynes, B.F.
登録日2014-10-07
公開日2015-08-12
最終更新日2015-09-02
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structural analysis of the unmutated ancestor of the HIV-1 envelope V2 region antibody CH58 isolated from an RV144 vaccine efficacy trial vaccinee.
EBioMedicine, 2, 2015
4RIR
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BU of 4rir by Molmil
Structural Analysis of the Unmutated Ancestor of the HIV-1 Envelope V2 Region Antibody CH58 Isolated From an RV144 HIV-1 Vaccine Efficacy Trial Vaccinee and Associated with Decreased Transmission Risk
分子名称: CH58-UA Fab heavy chain, CH58-UA Fab light chain
著者Nicely, N.I, Wiehe, K, Kepler, T.B, Jaeger, F.H, Dennison, S.M, Liao, H.-X, Alam, S.M, Hwang, K.-K, Bonsignori, M, Rerks-Ngarm, S, Nitayaphan, S, Pitisuttithum, P, Kaewkungwal, J, Robb, M.L, O'Connell, R.J, Michael, N.L, Kim, J.H, Haynes, B.F.
登録日2014-10-07
公開日2015-08-12
最終更新日2015-09-02
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structural analysis of the unmutated ancestor of the HIV-1 envelope V2 region antibody CH58 isolated from an RV144 vaccine efficacy trial vaccinee.
EBioMedicine, 2, 2015
4RJV
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BU of 4rjv by Molmil
Crystal Structure of a De Novo Designed Ferredoxin Fold, Northeast Structural Genomics Consortium (NESG) Target OR461
分子名称: OR461
著者O'Connell, P.T, Lin, Y.-R, Guan, R, Koga, N, Koga, R, Seetharaman, J, Janjua, H, Xiao, R, Maglaqui, M, Everett, J.K, Acton, T.B, Baker, D, Montelione, G.T, Northeast Structural Genomics Consortium (NESG)
登録日2014-10-09
公開日2014-10-22
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.523 Å)
主引用文献Northeast Structural Genomics Consortium Target OR461
To be published
4TLE
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BU of 4tle by Molmil
Crystal structure of N-terminal C1 domain of KaiC
分子名称: CHLORIDE ION, Circadian clock protein kinase KaiC, MAGNESIUM ION, ...
著者Abe, J, Hiyama, T.B, Mukaiyama, A, Son, S, Akiyama, S.
登録日2014-05-29
公開日2015-07-01
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (1.936 Å)
主引用文献Atomic-scale origins of slowness in the cyanobacterial circadian clock
Science, 349, 2015
6EVQ
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BU of 6evq by Molmil
solution NMR structure of EB1 C terminus (191-260) with a small molecule bound into the SxIP binding site
分子名称: (2~{R})-2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-~{N}-(furan-2-ylmethyl)propanamide, Microtubule-associated protein RP/EB family member 1
著者Barsukov, I.L, Almeida, T.B.
登録日2017-11-02
公開日2018-02-07
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Targeting SxIP-EB1 interaction: An integrated approach to the discovery of small molecule modulators of dynamic binding sites.
Sci Rep, 7, 2017
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
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
6DRI
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BU of 6dri by Molmil
NMR solution structure of Acan1 from the Ancylostoma caninum hookworm
分子名称: Acan1
著者Smallwood, T.B, Rosengren, K.J, Clark, R.J.
登録日2018-06-11
公開日2019-06-19
最終更新日2020-01-01
実験手法SOLUTION NMR
主引用文献NMR solution structure of Acan1 from the Ancylostoma caninum hookworm
To Be Published
6E12
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BU of 6e12 by Molmil
Crystal Structure of the Alr8543 protein in complex with Oleic Acid and magnesium ion from Nostoc sp. PCC 7120, Northeast Structural Genomics Consortium Target NsR141
分子名称: Alr8543 protein, CHLORIDE ION, MAGNESIUM ION, ...
著者Forouhar, F, Neely, H, Seetharaman, J, Xiao, R, Ciccosanti, C, Patel, D, Belote, R.L, Everett, J.K, Nair, R, Acton, T.B, Rost, B, Montelione, G.T, Tong, L, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
登録日2018-07-09
公開日2018-07-25
最終更新日2019-12-04
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Crystal Structure of the Alr8543 protein in complex with Oleic Acid and magnesium ion from Nostoc sp. PCC 7120, Northeast Structural Genomics Consortium Target NsR141
To Be Published
7SKW
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BU of 7skw by Molmil
Ab initio structure of triclinic lysozyme from electron-counted MicroED data
分子名称: Lysozyme C, NITRATE ION
著者Martynowycz, M.W, Clabbers, M.T.B, Hattne, J, Gonen, T.
登録日2021-10-21
公開日2022-06-08
最終更新日2022-06-22
実験手法ELECTRON CRYSTALLOGRAPHY (0.87 Å)
主引用文献Ab initio phasing macromolecular structures using electron-counted MicroED data.
Nat.Methods, 19, 2022
7SKX
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BU of 7skx by Molmil
Ab initio structure of proteinase K from electron-counted MicroED data
分子名称: 5-amino-2,4,6-triiodobenzene-1,3-dicarboxylic acid, CALCIUM ION, Proteinase K
著者Martynowycz, M.W, Clabbers, M.T.B, Hattne, J, Gonen, T.
登録日2021-10-21
公開日2022-06-08
最終更新日2022-06-22
実験手法ELECTRON CRYSTALLOGRAPHY (1.5 Å)
主引用文献Ab initio phasing macromolecular structures using electron-counted MicroED data.
Nat.Methods, 19, 2022
6EVI
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BU of 6evi by Molmil
solution NMR structure of EB1 C terminus (191-260)
分子名称: Microtubule-associated protein RP/EB family member 1
著者Barsukov, I.L, Almeida, T.B.
登録日2017-11-01
公開日2018-02-07
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献Targeting SxIP-EB1 interaction: An integrated approach to the discovery of small molecule modulators of dynamic binding sites.
Sci Rep, 7, 2017
7L2G
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BU of 7l2g by Molmil
NMR solution structure of Nak1 from the Necator americanus hookworm
分子名称: ShTK domain protein
著者Smallwood, T.B, Rosengren, K.J, Clark, R.J.
登録日2020-12-17
公開日2021-10-27
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Synthetic hookworm-derived peptides are potent modulators of primary human immune cell function that protect against experimental colitis in vivo.
J.Biol.Chem., 297, 2021
7P3S
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BU of 7p3s by Molmil
Crystal structure of Schistosoma mansoni HDAC8 complexed with a benzohydroxamate inhibitor 12
分子名称: GLYCEROL, Histone deacetylase, POTASSIUM ION, ...
著者Shaik, T.B, Romier, C.
登録日2021-07-08
公開日2021-09-15
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.546 Å)
主引用文献Synthesis, structure-activity relationships, cocrystallization and cellular characterization of novel smHDAC8 inhibitors for the treatment of schistosomiasis.
Eur.J.Med.Chem., 225, 2021
7PBJ
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BU of 7pbj by Molmil
Cryo-EM structure of the GroEL-GroES complex with ADP bound to both rings ("wide" conformation).
分子名称: 10 kDa chaperonin, 60 kDa chaperonin, ADENOSINE-5'-DIPHOSPHATE, ...
著者Pichkur, E.B, Stanishneva-Konovalova, T.B.
登録日2021-08-02
公開日2021-11-24
最終更新日2024-07-17
実験手法ELECTRON MICROSCOPY (3.4 Å)
主引用文献Novel cryo-EM structure of an ADP-bound GroEL-GroES complex.
Sci Rep, 11, 2021
7PBX
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BU of 7pbx by Molmil
Cryo-EM structure of the GroEL-GroES complex with ADP bound to both rings ("tight" conformation).
分子名称: 10 kDa chaperonin, 60 kDa chaperonin, ADENOSINE-5'-DIPHOSPHATE, ...
著者Pichkur, E.B, Stanishneva-Konovalova, T.B.
登録日2021-08-02
公開日2021-11-24
最終更新日2024-07-17
実験手法ELECTRON MICROSCOPY (3.43 Å)
主引用文献Novel cryo-EM structure of an ADP-bound GroEL-GroES complex.
Sci Rep, 11, 2021

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