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7A6O
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BU of 7a6o by Molmil
Crystal Structure of the Complex of the Recombinant Von Willebrand Factor AIM-A1 domain and VHH81 at 2.1 Angstrom resolution
分子名称: SULFATE ION, VHH81 Nanobody fragment, von Willebrand factor
著者Brown, A.K, Emsley, J.
登録日2020-08-25
公開日2021-03-03
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.117 Å)
主引用文献Activation of von Willebrand factor via mechanical unfolding of its discontinuous autoinhibitory module.
Nat Commun, 12, 2021
7B01
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BU of 7b01 by Molmil
ADAMTS13-CUB12
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Maltodextrin-binding protein,Maltodextrin-binding protein,Maltodextrin-binding protein,ADAMTS13 CUB12,A disintegrin and metalloproteinase with thrombospondin motifs 13,A disintegrin and metalloproteinase with thrombospondin motifs 13,A disintegrin and metalloproteinase with thrombospondin motifs 13, alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose
著者Kim, H.J, Emsley, J.
登録日2020-11-18
公開日2021-04-28
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Crystal structure of ADAMTS13 CUB domains reveals their role in global latency.
Sci Adv, 7, 2021
7PRK
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BU of 7prk by Molmil
Factor XII Fibronectin type II (FXII FnII) domain
分子名称: Coagulation factor XII, FORMIC ACID, ZINC ION
著者Kaira, B.G, Emsley, J.
登録日2021-09-21
公開日2022-10-05
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.64 Å)
主引用文献Factor XII Fibronectin type II (FXII FnII) domain
To Be Published
6GHA
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BU of 6gha by Molmil
USP15 catalytic domain structure
分子名称: Ubiquitin carboxyl-terminal hydrolase 15,Ubiquitin carboxyl-terminal hydrolase 15, ZINC ION
著者Ward, S.J, Gratton, H.E, Caulton, S.G, Emsley, J, Dreveny, I.
登録日2018-05-06
公開日2018-09-26
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.98 Å)
主引用文献The structure of the deubiquitinase USP15 reveals a misaligned catalytic triad and an open ubiquitin-binding channel.
J. Biol. Chem., 293, 2018
6GH9
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USP15 catalytic domain in complex with small molecule
分子名称: 1,4-DIHYDROXY-5,8-BIS({2-[(2-HYDROXYETHYL)AMINO]ETHYL}AMINO)-9,10-ANTHRACENEDIONE, DIMETHYL SULFOXIDE, Ubiquitin carboxyl-terminal hydrolase 15, ...
著者Ward, S.J, Gratton, H.E, Caulton, S.G, Emsley, J, Dreveny, I.
登録日2018-05-06
公開日2018-09-26
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2.09 Å)
主引用文献The structure of the deubiquitinase USP15 reveals a misaligned catalytic triad and an open ubiquitin-binding channel.
J. Biol. Chem., 293, 2018
6P4E
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BU of 6p4e by Molmil
Leishmania mexicana CPB in complex with an aza-nitrile inhibitor
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 3-tert-butyl-N-[(2S)-1-(2-cyano-1,2-dimethylhydrazinyl)-4-methyl-1-oxopentan-2-yl]-1-methyl-1H-pyrazole-5-carboxamide (non-preferred name), ...
著者Ribeiro, J.F.R, Li, C, De Vita, D, Emsley, J, Montanari, C.A.
登録日2019-05-27
公開日2020-06-03
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献High Resolution X-Ray Crystal Structures of LmCPB2.8 Co-Crystalized with Dipeptidyl Aza-nitrile Inhibitor and Structure Activity Relationships
To Be Published
6QF7
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BU of 6qf7 by Molmil
Crystal structures of the recombinant beta-Factor XIIa protease with bound Thr-Arg and Pro-Arg substrate mimetics
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Coagulation factor XII, ...
著者Pathak, M, Mannal, R, Li, C, Bubacarr, G.K, Badraldin, K.H, Belviso, B.D, Camila, R.B, Dreveny, I, Fischer, P.M, Dekker, L.V, Oliva, M.L.V, Emsley, J.
登録日2019-01-09
公開日2019-06-05
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (4 Å)
主引用文献Crystal structures of the recombinant beta-factor XIIa protease with bound Thr-Arg and Pro-Arg substrate mimetics.
Acta Crystallogr D Struct Biol, 75, 2019
6QIG
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Metalloproteinase
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Kim, H.J, Emsley, J.
登録日2019-01-18
公開日2019-09-04
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Crystal structure and substrate-induced activation of ADAMTS13.
Nat Commun, 10, 2019
3BX4
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BU of 3bx4 by Molmil
Crystal structure of the snake venom toxin aggretin
分子名称: Aggretin alpha chain, Aggretin beta chain, GLYCEROL, ...
著者Hooley, E, Papagrigoriou, E, Navdaev, A, Pandey, A, Clemetson, J.M, Clemetson, K.J, Emsley, J.
登録日2008-01-11
公開日2008-08-26
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献The crystal structure of the platelet activator aggretin reveals a novel (alphabeta)2 dimeric structure.
Biochemistry, 47, 2008
3DYJ
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BU of 3dyj by Molmil
Crystal Structure of the R11R12 Domains of Talin
分子名称: TALIN-1
著者Gingras, A.R, Joyce, M.G, Critchley, D.R, Emsley, J.
登録日2008-07-28
公開日2009-01-27
最終更新日2021-08-25
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Structural determinants of integrin binding to the talin rod
J.Biol.Chem., 284, 2009
3E3E
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BU of 3e3e by Molmil
Human Thioredoxin Double Mutant C35S,C73R
分子名称: HEXAETHYLENE GLYCOL, Thioredoxin
著者Hall, G, Emsley, J.
登録日2008-08-07
公開日2010-03-02
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.01 Å)
主引用文献Structure of human thioredoxin exhibits a large conformational change.
Protein Sci., 19, 2010
2M32
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BU of 2m32 by Molmil
Alpha-1 integrin I-domain in complex with GLOGEN triple helical peptide
分子名称: GLOGEN peptide, Integrin alpha-1, MAGNESIUM ION
著者Chin, Y, Headey, S, Mohanty, B, McEwan, P, Swarbrick, J, Mulhern, T, Emsley, J, Simpson, J, Scanlon, M.
登録日2013-01-07
公開日2013-11-06
最終更新日2014-02-12
実験手法SOLUTION NMR
主引用文献The Structure of Integrin alpha 1I Domain in Complex with a Collagen-mimetic Peptide.
J.Biol.Chem., 288, 2013
2OWL
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BU of 2owl by Molmil
Crystal structure of E. coli RdgC
分子名称: CALCIUM ION, Recombination-associated protein rdgC
著者Briggs, G.S, McEwan, P.A, Yu, J, Moore, T, Emsley, J, Lloyd, R.G.
登録日2007-02-16
公開日2007-03-20
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Ring Structure of the Escherichia coli DNA-binding Protein RdgC Associated with Recombination and Replication Fork Repair.
J.Biol.Chem., 282, 2007
6SZW
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BU of 6szw by Molmil
Asymmetric complex of Factor XII and kininogen with gC1qR/C1QBP/P32 is governed by allostery
分子名称: Coagulation factor XII, Complement component 1 Q subcomponent-binding protein, mitochondrial, ...
著者Kaira, B.G, Emsley, J.
登録日2019-10-02
公開日2020-07-22
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (3.14 Å)
主引用文献Factor XII and kininogen asymmetric assembly with gC1qR/C1QBP/P32 is governed by allostery.
Blood, 136, 2020
6GT6
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BU of 6gt6 by Molmil
Crystal structure of recombinant coagulation factor beta-XIIa
分子名称: CYSTEINE, Coagulation factor XII, GLYCEROL, ...
著者Pathak, M, Emsley, J.
登録日2018-06-15
公開日2019-07-17
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2.54 Å)
主引用文献Crystal structures of the recombinant beta-factor XIIa protease with bound Thr-Arg and Pro-Arg substrate mimetics.
Acta Crystallogr D Struct Biol, 75, 2019
6TPR
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BU of 6tpr by Molmil
PqsR (MvfR) bound to inhibitory compound 40
分子名称: 2-[(5-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-~{N}-(4-pyridin-2-yloxyphenyl)ethanamide, Transcriptional regulator MvfR
著者Richardson, W.K, Emsley, J.
登録日2019-12-14
公開日2020-05-13
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献Hit Identification of New Potent PqsR Antagonists as Inhibitors of Quorum Sensing in Planktonic and Biofilm GrownPseudomonas aeruginosa.
Front Chem, 8, 2020
5I25
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BU of 5i25 by Molmil
human recombinant coagulation FXI in complex with a peptide derived from human high molecular weight kininogen (HKP)
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, ASN-PRO-ILE-SER-ASP-PHE-PRO-ASP, Coagulation factor XI
著者Hall, G.A.F, Wong, S.S, Emsley, J.
登録日2016-02-08
公開日2016-04-06
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (2.85 Å)
主引用文献A novel DFP tripeptide motif interacts with the coagulation factor XI apple 2 domain.
Blood, 127, 2016
1ZW3
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BU of 1zw3 by Molmil
Vinculin Head (0-258) in Complex with the Talin Rod residues 1630-1652
分子名称: Talin 1, Vinculin
著者Gingras, A.R, Ziegler, W.H, Barsukov, I.L, Roberts, G.C, Critchley, D.R, Emsley, J.
登録日2005-06-03
公開日2005-09-20
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (3.3 Å)
主引用文献Mapping and consensus sequence identification for multiple vinculin binding sites within the talin rod
J.Biol.Chem., 280, 2005
1ZVZ
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BU of 1zvz by Molmil
Vinculin Head (0-258) in Complex with the Talin Rod Residue 820-844
分子名称: Talin 1, Vinculin
著者Gingras, A.R, Ziegler, W.H, Barsukov, I.L, Roberts, G.C, Critchley, D.R, Emsley, J.
登録日2005-06-03
公開日2005-09-20
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Mapping and consensus sequence identification for multiple vinculin binding sites within the talin rod
J.Biol.Chem., 280, 2005
1ZW2
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Vinculin Head (0-258) in Complex with the Talin Rod residues 2345-2369
分子名称: Vinculin, talin
著者Gingras, A.R, Ziegler, W.H, Barsukov, I.L, Roberts, G.C, Critchley, D.R, Emsley, J.
登録日2005-06-03
公開日2005-09-20
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Mapping and consensus sequence identification for multiple vinculin binding sites within the talin rod
J.Biol.Chem., 280, 2005
2B0H
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BU of 2b0h by Molmil
Solution structure of VBS3 fragment of talin
分子名称: Talin-1
著者Gingras, A.R, Vogel, K.P, Steinhoff, H.J, Ziegler, W.H, Patel, B, Emsley, J, Critchley, D.R, Roberts, G.C, Barsukov, I.L.
登録日2005-09-14
公開日2006-01-17
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Structural and Dynamic Characterization of a Vinculin Binding Site in the Talin Rod
Biochemistry, 45, 2006
5DWZ
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BU of 5dwz by Molmil
Structural and functional characterization of PqsBC, a condensing enzyme in the biosynthesis of the Pseudomonas aeruginosa quinolone signal
分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 3-oxoacyl-(Acyl carrier protein) synthase III, 3-oxoacyl-[acyl-carrier-protein] synthase 3, ...
著者Drees, S.L, Li, C, Prasetya, F, Saleem, M, Dreveny, I, Hennecke, U, Williams, P, Emsley, J, Fetzner, S.
登録日2015-09-23
公開日2016-02-03
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.04 Å)
主引用文献PqsBC, a Condensing Enzyme in the Biosynthesis of the Pseudomonas aeruginosa Quinolone Signal: CRYSTAL STRUCTURE, INHIBITION, AND REACTION MECHANISM.
J.Biol.Chem., 291, 2016
5EOD
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Human Plasma Coagulation FXI with peptide LP2
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Coagulation factor XI, LP2
著者Wong, S.S, Ostergaard, S, Hall, G, Li, C, Williams, P.M, Stennicke, H, Emsley, J.
登録日2015-11-10
公開日2016-04-06
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献A novel DFP tripeptide motif interacts with the coagulation factor XI apple 2 domain.
Blood, 127, 2016
5EOK
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Human Plasma Coagulation Factor XI in complex with peptide P39
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, Coagulation factor XI, ...
著者Wong, S.S, Ostergaard, S, Hall, G, Li, C, Williams, P.M, Stennicke, H, Emsley, J.
登録日2015-11-10
公開日2016-04-06
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献A novel DFP tripeptide motif interacts with the coagulation factor XI apple 2 domain.
Blood, 127, 2016
5JPZ
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Crystal structure of HAT domain of human Squamous Cell Carcinoma Antigen Recognized By T Cells 3, SART3 (TIP110)
分子名称: Squamous cell carcinoma antigen recognized by T-cells 3
著者Grazette, A, Harper, S, Emsley, J, Layfield, R, Dreveny, I.
登録日2016-05-04
公開日2016-05-11
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (3.045 Å)
主引用文献unpublished
To Be Published

225681

件を2024-10-02に公開中

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