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PDB: 5931 results

7X7M
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BU of 7x7m by Molmil
Lumazine Synthase from Aquifex aeolicus
Descriptor: 6,7-dimethyl-8-ribityllumazine synthase
Authors:Sobhy, M.A, Hamdan, S.M.
Deposit date:2022-03-09
Release date:2022-10-12
Last modified:2024-06-26
Method:ELECTRON MICROSCOPY (2.33 Å)
Cite:Cryo-electron structures of the extreme thermostable enzymes Sulfur Oxygenase Reductase and Lumazine Synthase.
Plos One, 17, 2022
7XKX
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BU of 7xkx by Molmil
Crystal structure of Tpn2
Descriptor: SQHop_cyclase_C domain-containing protein
Authors:Chang, C.Y, Stowell, E.A, Lin, Y.L, Ehrenberger, M.A, Rudolf, J.D.
Deposit date:2022-04-20
Release date:2023-03-01
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.57 Å)
Cite:Structure-guided product determination of the bacterial type II diterpene synthase Tpn2.
Commun Chem, 5, 2022
4TLN
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BU of 4tln by Molmil
BINDING OF HYDROXAMIC ACID INHIBITORS TO CRYSTALLINE THERMOLYSIN SUGGESTS A PENTACOORDINATE ZINC INTERMEDIATE IN CATALYSIS
Descriptor: CALCIUM ION, L-LEUCYL-HYDROXYLAMINE, THERMOLYSIN, ...
Authors:Matthews, B.W, Holmes, M.A.
Deposit date:1982-02-08
Release date:1982-05-26
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Binding of hydroxamic acid inhibitors to crystalline thermolysin suggests a pentacoordinate zinc intermediate in catalysis.
Biochemistry, 20, 1981
7Y6M
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Intracellular Subtilisin from Bacillus sp.
Descriptor: CALCIUM ION, DI(HYDROXYETHYL)ETHER, Intracellular serine protease
Authors:Hussin, N, Jamaluddin, H, Jonet, M.A.
Deposit date:2022-06-21
Release date:2022-07-20
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.703 Å)
Cite:Intracellular Subtilisin from Bacillus sp.
TO BE PUBLISHED
4RXY
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BU of 4rxy by Molmil
Crystal Structure of the Beta Carbonic Anhydrase psCA3 isolated from Pseudomonas aeruginosa
Descriptor: Carbonic anhydrase, GLYCEROL, ZINC ION
Authors:Pinard, M.A, Mckenna, R.
Deposit date:2014-12-12
Release date:2015-06-24
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.901 Å)
Cite:Structure and inhibition studies of a type II beta-carbonic anhydrase psCA3 from Pseudomonas aeruginosa.
Bioorg.Med.Chem., 23, 2015
7Z4S
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Crystal structure of SARS-CoV-2 Mpro in complex with cyclic peptide GM4 including unnatural amino acids.
Descriptor: 1,2-ETHANEDIOL, 3C-like proteinase nsp5, DI(HYDROXYETHYL)ETHER, ...
Authors:Owen, C.D, Miura, T, Malla, T, Lukacik, L, Strain-Damerell, C.M, Tumber, A, Brewitz, L, McDonough, M.A, Salah, E, Terasaka, N, Katoh, T, Kawamura, A, Schofield, C.J, Suga, H, Walsh, M.A.
Deposit date:2022-03-04
Release date:2023-03-22
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:In vitro selection of macrocyclic peptide inhibitors containing cyclic gamma 2,4 -amino acids targeting the SARS-CoV-2 main protease.
Nat.Chem., 15, 2023
6V99
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BU of 6v99 by Molmil
Agrobacterium tumefaciens ADP-Glucose pyrophosphorylase- S72D in the presence of sulfate
Descriptor: Glucose-1-phosphate adenylyltransferase, SULFATE ION
Authors:Zheng, Y, Alghamdi, M.A, Ballicora, M.A, Liu, D.
Deposit date:2019-12-13
Release date:2020-12-16
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.287 Å)
Cite:Site-directed mutagenesis of Serine-72 reveals the location of the fructose 6-phosphate regulatory site of the Agrobacterium tumefaciens ADP-glucose pyrophosphorylase.
Protein Sci., 31, 2022
6V96
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Agrobacterium tumefaciens ADP-Glucose pyrophosphorylase-S72E
Descriptor: CITRIC ACID, GLYCEROL, Glucose-1-phosphate adenylyltransferase
Authors:Zheng, Y, Hussien, R, Alghamdi, M.A, Ballicora, M.A, Liu, D.
Deposit date:2019-12-13
Release date:2020-12-16
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Site-directed mutagenesis of Serine-72 reveals the location of the fructose 6-phosphate regulatory site of the Agrobacterium tumefaciens ADP-glucose pyrophosphorylase.
Protein Sci., 31, 2022
6V9A
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BU of 6v9a by Molmil
Agrobacterium tumefaciens ADP-Glucose pyrophosphorylase-S72D
Descriptor: CITRIC ACID, GLYCEROL, Glucose-1-phosphate adenylyltransferase
Authors:Zheng, Y, Alghamdi, M.A, Ballicora, M.A, Liu, D.
Deposit date:2019-12-13
Release date:2020-12-16
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Site-directed mutagenesis of Serine-72 reveals the location of the fructose 6-phosphate regulatory site of the Agrobacterium tumefaciens ADP-glucose pyrophosphorylase.
Protein Sci., 31, 2022
1AYN
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BU of 1ayn by Molmil
HUMAN RHINOVIRUS 16 COAT PROTEIN
Descriptor: HUMAN RHINOVIRUS 16 COAT PROTEIN, LAURIC ACID, MYRISTIC ACID, ...
Authors:Hadfield, A.T, Oliveira, M.A, Zhao, R, Rossmann, M.G.
Deposit date:1997-11-06
Release date:1998-01-21
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:The structure of human rhinovirus 16.
Structure, 1, 1993
6HMX
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RIP2 Kinase Catalytic Domain complex with N(4,5dimethyl1Hpyrazol3yl)7methoxy6(2methylpropane2sulfonyl)quinolin4amine
Descriptor: 6-~{tert}-butylsulfonyl-~{N}-(3,4-dimethyl-1~{H}-pyrazol-5-yl)-7-methoxy-quinolin-4-amine, Receptor-interacting serine/threonine-protein kinase 2
Authors:Convery, M.A, Haile, P.A.
Deposit date:2018-09-13
Release date:2018-11-07
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (2.53 Å)
Cite:Identification of Quinoline-Based RIP2 Kinase Inhibitors with an Improved Therapeutic Index to the hERG Ion Channel.
ACS Med Chem Lett, 9, 2018
9FJN
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Solution NMR structure of a peptide encompassing residues 2-19 of the human formin INF2
Descriptor: Inverted formin-2
Authors:Jimenez, M.A, Comas, L, Labat-de-Hoz, L, Correas, I, Alonso, M.A.
Deposit date:2024-05-31
Release date:2024-09-11
Method:SOLUTION NMR
Cite:Structure and function of the N-terminal extension of the formin INF2.
Cell Mol Life Sci, 79, 2022
9FJW
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BU of 9fjw by Molmil
Solution NMR structure of a peptide encompassing residues 2-36 of the human formin INF2
Descriptor: Inverted formin-2
Authors:Jimenez, M.A, Comas, L, Labat-de-Hoz, L, Correas, I, Alonso, M.A.
Deposit date:2024-05-31
Release date:2024-09-11
Method:SOLUTION NMR
Cite:Structure and function of the N-terminal extension of the formin INF2.
Cell Mol Life Sci, 79, 2022
9COJ
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BU of 9coj by Molmil
SH3-like tandem domain of human KIN protein
Descriptor: DNA/RNA-binding protein KIN17
Authors:de Lourenco, I.O, Fossey, M.A, Souza, F.P, Seixas, F.A.V, Fernandez, M.A, Almeida, F.C.L, Caruso, I.P.
Deposit date:2024-07-16
Release date:2024-07-31
Method:SOLUTION NMR
Cite:Solution structure of SH3-like tandem domain of human KIN protein and its interaction with RNA homo-oligonucleotides
To Be Published
6UEQ
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BU of 6ueq by Molmil
Structure of TBP bound to C-C mismatch containing TATA site
Descriptor: DNA (5'-D(*GP*CP*TP*AP*TP*AP*AP*AP*AP*CP*GP*GP*CP*A)-3'), DNA (5'-D(*TP*GP*CP*CP*CP*TP*TP*TP*TP*AP*TP*AP*GP*C)-3'), SULFATE ION, ...
Authors:Schumacher, M.A, Al-Hashimi, H.
Deposit date:2019-09-22
Release date:2020-09-02
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:DNA mismatches reveal conformational penalties in protein-DNA recognition.
Nature, 587, 2020
6UL8
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BU of 6ul8 by Molmil
RIP2 kinase catalytic domain complex with (5S,6S,8R)-2-(benzo[d]thiazol-5-yl)-6-hydroxy-4,5,6,7,8,9-hexahydro-5,8-methanopyrazolo[1,5-a][1,3]diazocine-3-carboxamide
Descriptor: (5S,6S,8R)-2-(1,3-benzothiazol-5-yl)-6-hydroxy-4,5,6,7,8,9-hexahydro-5,8-methanopyrazolo[1,5-a][1,3]diazocine-3-carboxamide, CALCIUM ION, Receptor-interacting serine/threonine-protein kinase 2
Authors:Shewchuk, L.M, Convery, M.A.
Deposit date:2019-10-07
Release date:2019-12-04
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.68 Å)
Cite:Discovery of Pyrazolocarboxamides as Potent and Selective Receptor Interacting Protein 2 (RIP2) Kinase Inhibitors.
Acs Med.Chem.Lett., 10, 2019
8TV4
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BU of 8tv4 by Molmil
NMR structure of temporin L in solution
Descriptor: Temporin-1Tl peptide
Authors:McShan, A.C, Jia, R, Halim, M.A.
Deposit date:2023-08-17
Release date:2023-09-06
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Antiviral peptides inhibiting the main protease of SARS-CoV-2 investigated by computational screening and in vitro protease assay.
J.Pept.Sci., 30, 2024
5LUE
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BU of 5lue by Molmil
Minor form of the recombinant cytotoxin-1 from N. oxiana
Descriptor: VC-1=CYTOTOXIN
Authors:Dubovskii, P.V, Dubinnyi, M.A, Shulepko, M.A, Lyukmanova, E.N, Dolgikh, D.A, Kirpichnikov, M.P, Efremov, R.G.
Deposit date:2016-09-08
Release date:2017-09-20
Last modified:2024-10-23
Method:SOLUTION NMR
Cite:Structural and Dynamic "Portraits" of Recombinant and Native Cytotoxin I from Naja oxiana: How Close Are They?
Biochemistry, 56, 2017
7LEN
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BU of 7len by Molmil
Crystal structure of the epidermal growth factor receptor extracellular region with R84K mutation in complex with epiregulin crystallized with trehalose
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-6)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Hu, C, Leche II, C.A, Stayrook, S.E, Ferguson, K.M, Lemmon, M.A.
Deposit date:2021-01-14
Release date:2021-11-17
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Glioblastoma mutations alter EGFR dimer structure to prevent ligand bias.
Nature, 602, 2022
7LFS
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BU of 7lfs by Molmil
Crystal structure of the epidermal growth factor receptor extracellular region with A265V mutation in complex with epiregulin
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Isoform 4 of Epidermal growth factor receptor, ...
Authors:Hu, C, Leche II, C.A, Stayrook, S.E, Ferguson, K.M, Lemmon, M.A.
Deposit date:2021-01-18
Release date:2021-11-17
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (3.5 Å)
Cite:Glioblastoma mutations alter EGFR dimer structure to prevent ligand bias.
Nature, 602, 2022
7LFR
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BU of 7lfr by Molmil
Crystal structure of the epidermal growth factor receptor extracellular region with R84K mutation in complex with epiregulin crystallized with spermine
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Epidermal growth factor receptor, Proepiregulin, ...
Authors:Hu, C, Leche II, C.A, Stayrook, S.E, Ferguson, K.M, Lemmon, M.A.
Deposit date:2021-01-18
Release date:2021-11-17
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:Glioblastoma mutations alter EGFR dimer structure to prevent ligand bias.
Nature, 602, 2022
2Q0S
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BU of 2q0s by Molmil
Structure of the Inhibitor bound form of M. Smegmatis Aryl Esterase
Descriptor: Aryl esterase, SULFATE ION
Authors:Mathews, I.I, Soltis, M, Saldajeno, M, Ganshaw, G, Sala, R, Weyler, W, Cervin, M.A, Whited, G, Bott, R.
Deposit date:2007-05-22
Release date:2007-12-11
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Structure of a novel enzyme that catalyzes acyl transfer to alcohols in aqueous conditions.
Biochemistry, 46, 2007
2PUE
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BU of 2pue by Molmil
CRYSTAL STRUCTURE OF THE LACI FAMILY MEMBER, PURR, BOUND TO DNA: MINOR GROOVE BINDING BY ALPHA HELICES
Descriptor: ADENINE, DNA (5'-D(*TP*AP*CP*GP*CP*AP*AP*AP*CP*GP*TP*TP*TP*GP*CP*GP*T )-3'), PROTEIN (PURINE REPRESSOR )
Authors:Lu, F, Schumacher, M.A, Arvidson, D.N, Haldimann, A, Wanner, B.L, Zalkin, H, Brennan, R.G.
Deposit date:1997-10-04
Release date:1998-05-06
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Structure-based redesign of corepressor specificity of the Escherichia coli purine repressor by substitution of residue 190.
Biochemistry, 37, 1998
7LQP
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BU of 7lqp by Molmil
Rapid development of potent inhibitors of the HIV integrase-LEDGF interaction by fragment-linking using off-rate screening
Descriptor: 2-[2-[2-[3-[2-[2-[2-[[3-[2-[3-(2-hydroxy-2-oxoethyl)-5-methyl-1-benzofuran-2-yl]ethynyl]phenyl]carbonylamino]ethoxy]ethoxy]ethylcarbamoyl]phenyl]ethynyl]-5-methyl-1-benzofuran-3-yl]ethanoic acid, IODIDE ION, Integrase, ...
Authors:Gorman, M.A, Parker, M.W.
Deposit date:2021-02-15
Release date:2022-02-23
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (2.07 Å)
Cite:Rapid development of potent inhibitors of the HIV integrase-LEDGF interaction by fragment-linking using off-rate screening
To Be Published
2Q0Q
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BU of 2q0q by Molmil
Structure of the Native M. Smegmatis Aryl Esterase
Descriptor: GLYCEROL, SULFATE ION, aryl esterase
Authors:Mathews, I.I, Soltis, M, Saldajeno, M, Ganshaw, G, Sala, R, Weyler, W, Cervin, M.A, Whited, G, Bott, R.
Deposit date:2007-05-22
Release date:2007-12-11
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Structure of a novel enzyme that catalyzes acyl transfer to alcohols in aqueous conditions.
Biochemistry, 46, 2007

226707

数据于2024-10-30公开中

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