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PDB: 53266 件

8F43
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HNH Nuclease Domain from G. stearothermophilus Cas9, K597A mutant
分子名称: CRISPR-associated endonuclease Cas9
著者D'Ordine, A.M, Belato, H.B, Lisi, G.P, Jogl, G.
登録日2022-11-10
公開日2022-12-21
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.37 Å)
主引用文献Disruption of electrostatic contacts in the HNH nuclease from a thermophilic Cas9 rewires allosteric motions and enhances high-temperature DNA cleavage.
J.Chem.Phys., 157, 2022
8DAF
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Human SF-1 LBD bound to synthetic agonist 6N-10CA and bacterial phospholipid
分子名称: 10-[(3aR,6S,6aR)-3-phenyl-3a-(1-phenylethenyl)-6-(sulfamoylamino)-1,3a,4,5,6,6a-hexahydropentalen-2-yl]decanoic acid (non-preferred name), DI-PALMITOYL-3-SN-PHOSPHATIDYLETHANOLAMINE, Nuclear receptor coactivator 2, ...
著者D'Agostino, E.H, Cato, M.L, Ortlund, E.A.
登録日2022-06-13
公開日2023-06-28
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.59 Å)
主引用文献Comparison of activity, structure, and dynamics of SF-1 and LRH-1 complexed with small molecule modulators.
J.Biol.Chem., 299, 2023
7RCB
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Crystal Structure of a PMS2 VUS
分子名称: Mismatch repair endonuclease PMS2
著者D'Arcy, B.M, Prakash, A.
登録日2021-07-07
公開日2022-03-02
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献PMS2 variant results in loss of ATPase activity without compromising mismatch repair.
Mol Genet Genomic Med, 10, 2022
7RCI
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Crystal Structure of a PMS2 VUS with Substrate
分子名称: ADENOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, Mismatch repair endonuclease PMS2
著者D'Arcy, B.M, Prakash, A.
登録日2021-07-07
公開日2022-03-02
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.12 Å)
主引用文献PMS2 variant results in loss of ATPase activity without compromising mismatch repair.
Mol Genet Genomic Med, 10, 2022
7RCK
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Crystal Structure of PMS2 with Substrate
分子名称: ADENOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, Mismatch repair endonuclease PMS2
著者D'Arcy, B.M, Prakash, A.
登録日2021-07-07
公開日2022-03-02
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.04 Å)
主引用文献PMS2 variant results in loss of ATPase activity without compromising mismatch repair.
Mol Genet Genomic Med, 10, 2022
6MKH
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Crystal structure of pencillin binding protein 4 (PBP4) from Enterococcus faecalis in the imipenem-bound form
分子名称: (5R)-5-[(1S,2R)-1-formyl-2-hydroxypropyl]-3-[(2-{[(E)-iminomethyl]amino}ethyl)sulfanyl]-4,5-dihydro-1H-pyrrole-2-carbox ylic acid, PHOSPHATE ION, pencillin binding protein 4 (PBP4)
著者D'Andrea, E.D, Moon, T.M, Peti, W, Page, R.
登録日2018-09-25
公開日2018-10-31
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.62 Å)
主引用文献The structures of penicillin-binding protein 4 (PBP4) and PBP5 fromEnterococciprovide structural insights into beta-lactam resistance.
J. Biol. Chem., 293, 2018
6MKI
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Crystal structure of penicillin-binding protein 4 (PBP4) from Enterococcus faecalis in the ceftaroline-bound form
分子名称: Ceftaroline, bound form, GLYCEROL, ...
著者D'Andrea, E.D, Moon, T.M, Peti, W, Page, R.
登録日2018-09-25
公開日2018-10-31
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.984 Å)
主引用文献The structures of penicillin-binding protein 4 (PBP4) and PBP5 fromEnterococciprovide structural insights into beta-lactam resistance.
J. Biol. Chem., 293, 2018
6YRI
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THE CRYSTAL STRUCTURE OF THE COMPLEX OF HCAII WITH CAFFEIC ACID
分子名称: CAFFEIC ACID, Carbonic anhydrase 2, GLYCEROL, ...
著者D'Ambrosio, K, De Simone, G.
登録日2020-04-20
公開日2021-03-31
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Catechols: a new class of carbonic anhydrase inhibitors.
Chem.Commun.(Camb.), 56, 2020
8SP5
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LINE-1 retrotransposon endonuclease domain complex with Mn2+
分子名称: LINE-1 retrotransposon endonuclease, MANGANESE (II) ION, SULFATE ION
著者D'Ordine, A.M, Jogl, G, Sedivy, J.M.
登録日2023-05-02
公開日2024-05-22
実験手法X-RAY DIFFRACTION (2.23 Å)
主引用文献Identification and characterization of small molecule inhibitors of the LINE-1 retrotransposon endonuclease.
Nat Commun, 15, 2024
8CK1
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Carin 1 bacteriophage tail, connector and tail fibers assembly
分子名称: Connector Protein, Tail Nozzle, Tail fibers Dpo36
著者d'Acapito, A, Neumann, E, Schoehn, G.
登録日2023-02-14
公開日2023-03-15
最終更新日2023-05-10
実験手法ELECTRON MICROSCOPY (3.9 Å)
主引用文献Structural Study of the Cobetia marina Bacteriophage 1 (Carin-1) by Cryo-EM.
J.Virol., 97, 2023
8CJZ
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Carin1 bacteriophage mature capsid
分子名称: Capsid Decoration Protein, Major Capsid Protein, Spike Base Protein
著者d'Acapito, A, Neumann, E, Schoehn, G.
登録日2023-02-14
公開日2023-03-15
最終更新日2024-07-24
実験手法ELECTRON MICROSCOPY (3.5 Å)
主引用文献Structural Study of the Cobetia marina Bacteriophage 1 (Carin-1) by Cryo-EM.
J.Virol., 97, 2023
6MFQ
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BU of 6mfq by Molmil
Crystal structure of a PMS2 variant
分子名称: Mismatch repair endonuclease PMS2
著者D'Arcy, B.M, Prakash, A.
登録日2018-09-11
公開日2019-02-06
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Biochemical and structural characterization of two variants of uncertain significance in the PMS2 gene.
Hum. Mutat., 40, 2019
7JYD
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BU of 7jyd by Molmil
Human Liver Receptor Homolog-1 in Complex with 10CA and a Fragment of Tif2
分子名称: 10-[(3aR,6R,6aR)-6-hydroxy-3-phenyl-3a-(1-phenylethenyl)-1,3a,4,5,6,6a-hexahydropentalen-2-yl]decanoic acid, Nuclear receptor coactivator 2, Nuclear receptor subfamily 5 group A member 2
著者D'Agostino, E.H, Mays, S.G, Ortlund, E.A.
登録日2020-08-30
公開日2022-03-02
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Tapping into a phospholipid-LRH-1 axis yields a powerful anti-inflammatory agent with in vivo activity against colitis
To Be Published
7JYE
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Human Liver Receptor Homolog-1 in Complex with 9ChoP and a Fragment of Tif2
分子名称: 9-[(3~{a}~{R},6~{R},6~{a}~{R})-6-oxidanyl-3-phenyl-3~{a}-(1-phenylethenyl)-4,5,6,6~{a}-tetrahydro-1~{H}-pentalen-2-yl]nonyl 2-(trimethyl-$l^{4}-azanyl)ethyl hydrogen phosphate, Nuclear receptor coactivator 2, Nuclear receptor subfamily 5 group A member 2
著者D'Agostino, E.H, Mays, S.G, Ortlund, E.A.
登録日2020-08-30
公開日2022-03-02
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.551 Å)
主引用文献Tapping into a phospholipid-LRH-1 axis yields a powerful anti-inflammatory agent with in vivo activity against colitis
To Be Published
6ZR9
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BU of 6zr9 by Molmil
The crystal structure of the complex of hCAVII with 2-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)acetamide
分子名称: 2-[4-(diphenylmethyl)piperazin-1-yl]-~{N}-(4-sulfamoylphenyl)ethanamide, Carbonic anhydrase 7, ZINC ION
著者D'Ambrosio, K, De Simone, G, Di Fiore, A.
登録日2020-07-11
公開日2021-06-16
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献The crystal structures of 2-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)acetamide in complex with human carbonic anhydrase II and VII provide insights into selective CA inhibitor development
New J.Chem., 45, 2021
3GLX
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BU of 3glx by Molmil
Crystal Structure Analysis of the DtxR(E175K) complexed with Ni(II)
分子名称: Diphtheria toxin repressor, NICKEL (II) ION, PHOSPHATE ION
著者D'Aquino, J.A, Denninger, A, Moulin, A, D'Aquino, K.E, Ringe, D.
登録日2009-03-12
公開日2009-06-09
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Decreased sensitivity to changes in the concentration of metal ions as the basis for the hyperactivity of DtxR(E175K).
J.Mol.Biol., 390, 2009
5BRD
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BU of 5brd by Molmil
Crystal structure of Trypanosoma cruzi glucokinase in complex with inhibitor BENZ-GlcN
分子名称: 2-(benzoylamino)-2-deoxy-beta-D-glucopyranose, Glucokinase 1, putative
著者D'Antonio, E.L, Perry, K, Deinema, M.S, Kearns, S.P, Frey, T.A.
登録日2015-05-30
公開日2015-06-17
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structure-based approach to the identification of a novel group of selective glucosamine analogue inhibitors of Trypanosoma cruzi glucokinase.
Mol.Biochem.Parasitol., 204, 2016
8D35
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BU of 8d35 by Molmil
Crystal structure of SARS-CoV-2 main protease (Mpro) C145A mutant in complex with peptide from human tRNA methyltransferase TRMT1
分子名称: 3C-like proteinase nsp5, CHLORIDE ION, GLYCEROL, ...
著者D'Oliviera, A, Mugridge, J.S.
登録日2022-05-31
公開日2023-03-01
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Recognition and Cleavage of Human tRNA Methyltransferase TRMT1 by the SARS-CoV-2 Main Protease.
Elife, 2023
5BRF
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Crystal structure of Trypanosoma cruzi glucokinase in complex with inhibitor HPOP-GlcN
分子名称: 2-deoxy-2-{[3-(4-hydroxyphenyl)propanoyl]amino}-alpha-D-glucopyranose, Glucokinase 1, putative
著者D'Antonio, E.L, Perry, K, Deinema, M.S, Kearns, S.P, Frey, T.A.
登録日2015-05-30
公開日2015-06-17
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.102 Å)
主引用文献Structure-based approach to the identification of a novel group of selective glucosamine analogue inhibitors of Trypanosoma cruzi glucokinase.
Mol.Biochem.Parasitol., 204, 2016
5BRE
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BU of 5bre by Molmil
Crystal structure of Trypanosoma cruzi glucokinase in complex with inhibitor CBZ-GlcN
分子名称: 2-{[(benzyloxy)carbonyl]amino}-2-deoxy-beta-D-glucopyranose, Glucokinase 1, putative
著者D'Antonio, E.L, Perry, K, Deinema, M.S, Kearns, S.P, Frey, T.A.
登録日2015-05-30
公開日2015-06-17
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structure-based approach to the identification of a novel group of selective glucosamine analogue inhibitors of Trypanosoma cruzi glucokinase.
Mol.Biochem.Parasitol., 204, 2016
6FTK
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Gp36-MPER
分子名称: Envelope protein
著者D'Ursi, A.M, Grimaldi, M.
登録日2018-02-22
公開日2019-03-20
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献NMR Structure of the FIV gp36 C-Terminal Heptad Repeat and Membrane-Proximal External Region.
Int J Mol Sci, 21, 2020
5BRH
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BU of 5brh by Molmil
Crystal structure of Trypanosoma cruzi glucokinase in complex with inhibitor DBT-GlcN
分子名称: 2-deoxy-2-({[(1,1-dioxido-1-benzothiophen-2-yl)methoxy]carbonyl}amino)-beta-D-glucopyranose, Glucokinase 1, putative
著者D'Antonio, E.L, Perry, K, Deinema, M.S, Kearns, S.P, Frey, T.A.
登録日2015-05-30
公開日2015-06-17
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structure-based approach to the identification of a novel group of selective glucosamine analogue inhibitors of Trypanosoma cruzi glucokinase.
Mol.Biochem.Parasitol., 204, 2016
8CK0
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BU of 8ck0 by Molmil
Carin1 bacteriophage portal assembly
分子名称: Portal protein
著者d'Acapito, A, Neumann, E, Schoehn, G.
登録日2023-02-14
公開日2023-03-15
最終更新日2024-07-24
実験手法ELECTRON MICROSCOPY (3.8 Å)
主引用文献Structural Study of the Cobetia marina Bacteriophage 1 (Carin-1) by Cryo-EM.
J.Virol., 97, 2023
3HJP
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BU of 3hjp by Molmil
The crystal structure of Bcp4 from Sulfolobus Solfataricus
分子名称: CHLORIDE ION, Peroxiredoxin, bacterioferritin comigratory protein homolog (Bcp-4)
著者D'Ambrosio, K, De Simone, G.
登録日2009-05-22
公開日2010-05-26
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.55 Å)
主引用文献Exploring the catalytic mechanism of the first dimeric Bcp: functional, structural and docking analysis
To be Published
1P92
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Crystal Structure of (H79A)DtxR
分子名称: BETA-MERCAPTOETHANOL, Diphtheria toxin repressor
著者D'Aquino, J.A, Ringe, D.
登録日2003-05-08
公開日2004-05-25
最終更新日2023-08-16
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Determinants of the SRC homology domain 3-like fold.
J.Bacteriol., 185, 2003

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件を2024-09-04に公開中

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