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6BY7
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BU of 6by7 by Molmil
Folding DNA into a lipid-conjugated nano-barrel for controlled reconstitution of membrane proteins
分子名称: DNA (26-MER), DNA (27-MER), DNA (29-MER), ...
著者Dong, Y, Chen, S, Zhang, S, Sodroski, J, Yang, Z, Liu, D, Mao, Y.
登録日2017-12-20
公開日2018-02-28
最終更新日2024-03-13
実験手法ELECTRON MICROSCOPY (7.5 Å)
主引用文献Folding DNA into a Lipid-Conjugated Nanobarrel for Controlled Reconstitution of Membrane Proteins.
Angew. Chem. Int. Ed. Engl., 57, 2018
4PVG
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BU of 4pvg by Molmil
Crystal structure of protein tyrosine phosphatase Shp2 catalytic domain complex with small molecular compound L88N79
分子名称: 2-[3-({4-[(1,3-benzodioxol-5-ylmethyl)amino]-4-oxobutanoyl}amino)phenyl]-6-hydroxy-3-iodo-1-methyl-1H-indole-5-carboxylic acid, Tyrosine-protein phosphatase non-receptor type 11
著者Zhang, Z.-Y, Zeng, L, Liu, D, Yu, Z.
登録日2014-03-17
公開日2015-04-15
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Crystal structure of protein tyrosine Shp2 catalytic domain complex with compound L88N79
To be Published
4RBN
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BU of 4rbn by Molmil
The crystal structure of Nitrosomonas europaea sucrose synthase: Insights into the evolutionary origin of sucrose metabolism in prokaryotes
分子名称: Sucrose synthase:Glycosyl transferases group 1
著者Wu, R, Asencion Diez, M.D, Figueroa, C.M, Machtey, M, Iglesias, A.A, Ballicora, M.A, Liu, D.
登録日2014-09-12
公開日2015-07-01
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (3.05 Å)
主引用文献The Crystal Structure of Nitrosomonas europaea Sucrose Synthase Reveals Critical Conformational Changes and Insights into Sucrose Metabolism in Prokaryotes.
J.Bacteriol., 197, 2015
7WJU
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BU of 7wju by Molmil
Cryo-EM structure of the AsCas12f1-sgRNAv1-dsDNA ternary complex
分子名称: Non-target strand, OrfB_Zn_ribbon domain-containing protein, Target strand, ...
著者Wu, Z, Liu, D, Shen, H, Ji, Q.
登録日2022-01-07
公開日2023-01-18
実験手法ELECTRON MICROSCOPY (2.69 Å)
主引用文献Structure-directed functional evolution of the miniature CRISPR-AsCas12f1 system
To Be Published
7EZO
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BU of 7ezo by Molmil
GH10 domain of bifunctional endoxylanase and arabinofuranosidase of Bi0569
分子名称: endoxylanase/arabinofuranosidase
著者Wang, C.Y, Liu, D.
登録日2021-06-01
公開日2022-07-13
実験手法X-RAY DIFFRACTION (2.80005527 Å)
主引用文献GH10 domain of bifunctional endoxylanase and arabinofuranosidase of Bi0569
To Be Published
7JH4
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BU of 7jh4 by Molmil
Crystal structure of NAD(P)H-flavin oxidoreductase (NfoR) from S. aureus complexed with reduced FMN and NAD+
分子名称: 1-DEOXY-1-(7,8-DIMETHYL-2,4-DIOXO-3,4-DIHYDRO-2H-BENZO[G]PTERIDIN-1-ID-10(5H)-YL)-5-O-PHOSPHONATO-D-RIBITOL, NAD(P)H-dependent oxidoreductase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
著者Zheng, Y, O'Neill, A.G, Beaupre, B.A, Liu, D, Moran, G.R.
登録日2020-07-20
公開日2020-09-16
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献NfoR: Chromate Reductase or Flavin Mononucleotide Reductase?
Appl.Environ.Microbiol., 86, 2020
7JX9
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BU of 7jx9 by Molmil
The crystal structure of human ornithine aminotransferase with an intermediate bound during inactivation by (1S,3S)-3-amino-4-(hexafluoropropan-2-ylidenyl)-cyclopentane-1-carboxylic acid.
分子名称: (1S,3S,4S)-3-[(E)-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methylidene)amino]-4-(1,1,3,3,3-pentafluoroprop-1-en-2-yl)cyclopentane-1-carboxylic acid, N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]glycine, Ornithine aminotransferase, ...
著者Butrin, A, Beaupre, B, Shen, S, Silverman, R.B, Moran, G, Liu, D.
登録日2020-08-26
公開日2021-01-06
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.96 Å)
主引用文献Structural and Kinetic Analyses Reveal the Dual Inhibition Modes of Ornithine Aminotransferase by (1 S ,3 S )-3-Amino-4-(hexafluoropropan-2-ylidenyl)-cyclopentane-1-carboxylic Acid (BCF 3 ).
Acs Chem.Biol., 16, 2021
7ULU
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BU of 7ulu by Molmil
Human DDAH1 soaked with its inhibitor ClPyrAA
分子名称: (2S)-2-amino-4-[(pyridin-2-yl)amino]butanoic acid, N(G),N(G)-dimethylarginine dimethylaminohydrolase 1
著者Butrin, A, Zheng, Y, Tuley, A, Liu, D, Fast, W.
登録日2022-04-05
公開日2023-08-30
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Optimization of a switchable electrophile fragment into a potent and selective covalent inhibitor of human DDAH1
To Be Published
7ULX
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BU of 7ulx by Molmil
Human DDAH1 soaked with its inhibitor N4-(4-chloropyridin-2-yl)-L-asparagine
分子名称: N(G),N(G)-dimethylarginine dimethylaminohydrolase 1, N-(pyridin-2-yl)-L-asparagine
著者Zheng, Y, Butrin, A, Tuley, A, Liu, D, Fast, W.
登録日2022-04-05
公開日2023-08-30
実験手法X-RAY DIFFRACTION (1.707 Å)
主引用文献Optimization of a switchable electrophile fragment into a potent and selective covalent inhibitor of human DDAH1
To Be Published
7ULV
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BU of 7ulv by Molmil
Human DDAH1 soaked with its inactivator S-((4-chloropyridin-2-yl)methyl)-L-cysteine
分子名称: N(G),N(G)-dimethylarginine dimethylaminohydrolase 1, S-[(pyridin-2-yl)methyl]-L-cysteine
著者Zheng, Y, Butrin, A, Tuley, A, Liu, D, Fast, W.
登録日2022-04-05
公開日2023-08-30
実験手法X-RAY DIFFRACTION (2.37 Å)
主引用文献Optimization of a switchable electrophile fragment into a potent and selective covalent inhibitor of human DDAH1
To Be Published
7W9P
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BU of 7w9p by Molmil
Cryo-EM structure of human Nav1.7(E406K) in complex with auxiliary beta subunits, huwentoxin-IV and saxitoxin (S6IV pi helix conformer)
分子名称: (2S,3R,4E)-2-(acetylamino)-3-hydroxyoctadec-4-en-1-yl dihydrogen phosphate, 1,2-DIOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 1-O-OCTADECYL-SN-GLYCERO-3-PHOSPHOCHOLINE, ...
著者Yan, N, Huang, G, Liu, D, Wei, P, Shen, H.
登録日2021-12-10
公開日2022-05-25
実験手法ELECTRON MICROSCOPY (2.9 Å)
主引用文献High-resolution structures of human Na v 1.7 reveal gating modulation through alpha-pi helical transition of S6 IV.
Cell Rep, 39, 2022
7W9T
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BU of 7w9t by Molmil
Cryo-EM structure of human Nav1.7(E406K) in complex with auxiliary beta subunits, huwentoxin-IV and saxitoxin (S6IV alpha helix conformer)
分子名称: (3beta,14beta,17beta,25R)-3-[4-methoxy-3-(methoxymethyl)butoxy]spirost-5-en, 1,2-DIOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 1-O-OCTADECYL-SN-GLYCERO-3-PHOSPHOCHOLINE, ...
著者Yan, N, Huang, G, Liu, D, Wei, P.
登録日2021-12-10
公開日2022-05-25
実験手法ELECTRON MICROSCOPY (3 Å)
主引用文献High-resolution structures of human Na v 1.7 reveal gating modulation through alpha-pi helical transition of S6 IV.
Cell Rep, 39, 2022
7W9M
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BU of 7w9m by Molmil
Cryo-EM structure of human Nav1.7(E406K) in complex with auxiliary beta subunits, ProTx-II and tetrodotoxin (S6IV pi helix conformer)
分子名称: (1R,5R,6R,7R,9S,11S,12S,13S,14S)-3-amino-14-(hydroxymethyl)-8,10-dioxa-2,4-diazatetracyclo[7.3.1.1~7,11~.0~1,6~]tetradec-3-ene-5,9,12,13,14-pentol (non-preferred name), 1-O-OCTADECYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Yan, N, Huang, G, Liu, D, Wei, P, Shen, H.
登録日2021-12-10
公開日2022-05-25
実験手法ELECTRON MICROSCOPY (3 Å)
主引用文献High-resolution structures of human Na v 1.7 reveal gating modulation through alpha-pi helical transition of S6 IV.
Cell Rep, 39, 2022
7W9K
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BU of 7w9k by Molmil
Cryo-EM structure of human Nav1.7-beta1-beta2 complex at 2.2 angstrom resolution
分子名称: (2S,3R,4E)-2-(acetylamino)-3-hydroxyoctadec-4-en-1-yl dihydrogen phosphate, (3beta,14beta,17beta,25R)-3-[4-methoxy-3-(methoxymethyl)butoxy]spirost-5-en, 1,2-DIOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, ...
著者Yan, N, Huang, G, Liu, D, Wei, P, Shen, H.
登録日2021-12-09
公開日2022-06-01
実験手法ELECTRON MICROSCOPY (2.2 Å)
主引用文献High-resolution structures of human Na v 1.7 reveal gating modulation through alpha-pi helical transition of S6 IV.
Cell Rep, 39, 2022
7W9L
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BU of 7w9l by Molmil
Cryo-EM structure of human Nav1.7(E406K)-beta1-beta2 complex
分子名称: (3beta,14beta,17beta,25R)-3-[4-methoxy-3-(methoxymethyl)butoxy]spirost-5-en, 1,2-DIOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 1-O-OCTADECYL-SN-GLYCERO-3-PHOSPHOCHOLINE, ...
著者Yan, N, Huang, G, Liu, D, Wei, P, Shen, H.
登録日2021-12-10
公開日2022-06-01
実験手法ELECTRON MICROSCOPY (3.5 Å)
主引用文献High-resolution structures of human Na v 1.7 reveal gating modulation through alpha-pi helical transition of S6 IV.
Cell Rep, 39, 2022
1BNP
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BU of 1bnp by Molmil
NMR SOLUTION STRUCTURE OF THE N-TERMINAL DOMAIN OF DNA POLYMERASE BETA, 55 STRUCTURES
分子名称: DNA POLYMERASE BETA
著者Liu, D.-J, Prasad, R, Wilson, S.H, Derose, E.F, Mullen, G.P.
登録日1996-04-25
公開日1996-12-07
最終更新日2022-02-16
実験手法SOLUTION NMR
主引用文献Three-dimensional solution structure of the N-terminal domain of DNA polymerase beta and mapping of the ssDNA interaction interface.
Biochemistry, 35, 1996
1BNO
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BU of 1bno by Molmil
NMR SOLUTION STRUCTURE OF THE N-TERMINAL DOMAIN OF DNA POLYMERASE BETA, MINIMIZED AVERAGE STRUCTURE
分子名称: DNA POLYMERASE BETA
著者Liu, D.-J, Prasad, R, Wilson, S.H, Derose, E.F, Mullen, G.P.
登録日1996-04-25
公開日1996-12-07
最終更新日2022-02-16
実験手法SOLUTION NMR
主引用文献Three-dimensional solution structure of the N-terminal domain of DNA polymerase beta and mapping of the ssDNA interaction interface.
Biochemistry, 35, 1996
6JL7
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BU of 6jl7 by Molmil
crystal structure of TBC1D23 N terminal domain
分子名称: TBC1 domain family member 23
著者Sun, Q, Hu, W, Jia, D.
登録日2019-03-04
公開日2020-03-04
最終更新日2021-09-15
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structure of TBC1D23 N-terminus reveals a novel role for rhodanese domain.
Plos Biol., 18, 2020
1YYB
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BU of 1yyb by Molmil
Solution structure of 1-26 fragment of human programmed cell death 5 protein
分子名称: Programmed cell death protein 5
著者Liu, D.S, Feng, Y.G, Yao, H.W, Wang, J.F.
登録日2005-02-24
公開日2005-09-13
最終更新日2022-03-02
実験手法SOLUTION NMR
主引用文献The N-terminal 26-residue fragment of human programmed cell death 5 protein can form a stable alpha-helix having unique electrostatic potential character.
Biochem.J., 392, 2005
7F29
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BU of 7f29 by Molmil
Cryo-EM structure of the fibril formed by disaccharide-modified amyloid-beta(1-42)
分子名称: ACETIC ACID, Amyloid-beta A4 protein, beta-D-galactopyranose-(1-3)-2-amino-2-deoxy-alpha-D-galactopyranose
著者Xia, W.C, Sun, Y.P, Liu, C.
登録日2021-06-10
公開日2022-07-13
実験手法ELECTRON MICROSCOPY (3.1 Å)
主引用文献O-Glycosylation Induces Amyloid-beta To Form New Fibril Polymorphs Vulnerable for Degradation
J.Am.Chem.Soc., 143, 2021
7FH1
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BU of 7fh1 by Molmil
Structure of the human Meckelin
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Meckelin, beta-D-mannopyranose-(1-3)-[beta-D-mannopyranose-(1-6)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose
著者Gong, D.S.
登録日2021-07-29
公開日2021-12-01
実験手法ELECTRON MICROSCOPY (3.34 Å)
主引用文献Structure of the human Meckel-Gruber protein Meckelin.
Sci Adv, 7, 2021
7T2Z
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BU of 7t2z by Molmil
The structure of Haemophilus influenzae Rd KW20 nitroreductase complexed with 1-methyl-5-nitroimidazole
分子名称: 1,2-ETHANEDIOL, 1-methyl-5-nitro-1H-imidazole, ACETIC ACID, ...
著者Wanniarachchi, T.N, Bruner, S.D.
登録日2021-12-06
公開日2022-02-23
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.2547 Å)
主引用文献Biochemical and structural characterization of Haemophilus influenzae nitroreductase in metabolizing nitroimidazoles.
Rsc Chem Biol, 3, 2022
7T33
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BU of 7t33 by Molmil
The structure of Haemophilus influenzae Rd KW20 nitroreductase complexed with nicotinic acid
分子名称: FLAVIN MONONUCLEOTIDE, NICOTINIC ACID, Putative NAD(P)H nitroreductase, ...
著者Wanniarachchi, T.N, Bruner, S.D.
登録日2021-12-06
公開日2022-02-23
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.301 Å)
主引用文献Biochemical and structural characterization of Haemophilus influenzae nitroreductase in metabolizing nitroimidazoles.
Rsc Chem Biol, 3, 2022
7VKI
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BU of 7vki by Molmil
ESRP1 qRRM2 in complex with 12mer-RNA
分子名称: Epithelial splicing regulatory protein 1, RNA (12-mer)
著者Wu, B.X, Patel, D.J.
登録日2021-09-30
公開日2022-10-05
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献ESRP1 controls biogenesis and function of a large abundant multiexon circRNA.
Nucleic Acids Res., 2023
4J51
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BU of 4j51 by Molmil
Cyrstal structure of protein tyrosine phosphatase Lyp catalytic domain complex with small molecular inhibitor L75N04
分子名称: 3-[(3-chlorophenyl)ethynyl]-2-{4-[2-(cyclopropylamino)-2-oxoethoxy]phenyl}-6-hydroxy-1-benzofuran-5-carboxylic acid, Tyrosine-protein phosphatase non-receptor type 22
著者Liu, D, He, Y, Zhang, Z.-Y.
登録日2013-02-07
公開日2013-07-24
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献A Potent and Selective Small-Molecule Inhibitor for the Lymphoid-Specific Tyrosine Phosphatase (LYP), a Target Associated with Autoimmune Diseases.
J.Med.Chem., 56, 2013

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