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PDB: 56 件

3K7Y
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Aspartate Aminotransferase of Plasmodium falciparum
分子名称: ACETATE ION, Aspartate aminotransferase, PYRIDOXAL-5'-PHOSPHATE
著者Groves, M.R, Jordanova, R, Jain, R, Wrenger, C, Muller, I.B.
登録日2009-10-13
公開日2010-10-13
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Specific Inhibition of the Aspartate Aminotransferase of Plasmodium falciparum.
J.Mol.Biol., 405, 2011
1CZI
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CHYMOSIN COMPLEX WITH THE INHIBITOR CP-113972
分子名称: CHYMOSIN, CP-113972 (NORSTATINE-S-METHYL CYSTEINE-IODO-PHENYLALANINE-PROLINE)
著者Groves, M.R, Dhanaraj, V, Pitts, J.E, Badasso, M, Hoover, D, Nugent, P, Blundell, T.L.
登録日1997-01-15
公開日1997-04-01
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献A 2.3 A resolution structure of chymosin complexed with a reduced bond inhibitor shows that the active site beta-hairpin flap is rearranged when compared with the native crystal structure.
Protein Eng., 11, 1998
1PCI
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PROCARICAIN
分子名称: PROCARICAIN
著者Groves, M.R, Taylor, M.A.J, Scott, M, Cummings, N.J, Pickersgill, R.W, Jenkins, J.A.
登録日1996-06-28
公開日1997-04-01
最終更新日2023-08-09
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献The prosequence of procaricain forms an alpha-helical domain that prevents access to the substrate-binding cleft.
Structure, 4, 1996
2OB1
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ppm1 with 1,8-ANS
分子名称: Leucine carboxyl methyltransferase 1, PHOSPHATE ION
著者Groves, M.R.
登録日2006-12-18
公開日2007-01-30
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献A method for the general identification of protein crystals in crystallization experiments using a noncovalent fluorescent dye.
Acta Crystallogr.,Sect.D, 63, 2007
2OB2
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ppm1 in the absence of 1,8-ANS (cf 1JD)
分子名称: GLYCEROL, Leucine carboxyl methyltransferase 1, PHOSPHATE ION, ...
著者Groves, M.R, Mueller, I.B, Kreplin, X, Mueller-Dieckmann, J.
登録日2006-12-18
公開日2007-01-30
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (1.92 Å)
主引用文献A method for the general identification of protein crystals in crystallization experiments using a noncovalent fluorescent dye.
Acta Crystallogr.,Sect.D, 63, 2007
1BZJ
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Human ptp1b complexed with tpicooh
分子名称: 6-(DIFLUORO-PHOSPHONO-METHYL)-NAPHTHALENE-2-CARBOXYLIC ACID, PROTEIN (PROTEIN-TYROSINE-PHOSPHATASE)
著者Groves, M.R, Yao, Z.-J, Barford Jr, D.T.B.
登録日1998-10-29
公開日1999-02-16
最終更新日2023-08-09
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Structural basis for inhibition of the protein tyrosine phosphatase 1B by phosphotyrosine peptide mimetics.
Biochemistry, 37, 1998
1BZH
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Cyclic peptide inhibitor of human PTP1B
分子名称: PROTEIN (PROTEIN-TYROSINE-PHOSPHATASE 1B INHIBITOR), PROTEIN (PROTEIN-TYROSINE-PHOSPHATASE 1B)
著者Groves, M.R, Yao, Z.J, Burke Jr, T.R, Barford, D.
登録日1998-10-28
公開日1999-02-16
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structural basis for inhibition of the protein tyrosine phosphatase 1B by phosphotyrosine peptide mimetics.
Biochemistry, 37, 1998
1BZC
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HUMAN PTP1B CATALYTIC DOMAIN COMPLEXED WITH TPI
分子名称: 4-CARBAMOYL-4-{[6-(DIFLUORO-PHOSPHONO-METHYL)-NAPHTHALENE-2-CARBONYL]-AMINO}-BUTYRIC ACID, PROTEIN (PROTEIN-TYROSINE-PHOSPHATASE)
著者Groves, M.R, Yao, Z.J, Jr Burke, T.R, Barford, D.
登録日1998-10-27
公開日1999-02-16
最終更新日2023-08-09
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Structural basis for inhibition of the protein tyrosine phosphatase 1B by phosphotyrosine peptide mimetics.
Biochemistry, 37, 1998
1B3U
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CRYSTAL STRUCTURE OF CONSTANT REGULATORY DOMAIN OF HUMAN PP2A, PR65ALPHA
分子名称: PROTEIN (PROTEIN PHOSPHATASE PP2A)
著者Groves, M.R, Hanlon, N, Turowski, P, Hemmings, B, Barford, D.
登録日1998-12-14
公開日1999-04-12
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献The structure of the protein phosphatase 2A PR65/A subunit reveals the conformation of its 15 tandemly repeated HEAT motifs.
Cell(Cambridge,Mass.), 96, 1999
7O9T
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Crystal structure of Human Menin in apo form
分子名称: 1,2-ETHANEDIOL, Menin
著者Groves, M.R, Gao, K.
登録日2021-04-17
公開日2022-07-27
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.159 Å)
主引用文献Crystal structure of Human Menin in apo form
To Be Published
7O9Z
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Crystal structure of Human Menin in complex with BD-08
分子名称: (~{E})-2-cyano-3-(2~{H}-indazol-6-yl)-~{N}-(2-morpholin-4-ylethyl)prop-2-enamide, 1,2-ETHANEDIOL, GLYCEROL, ...
著者Groves, M.R, Gao, K.
登録日2021-04-18
公開日2022-07-27
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.979 Å)
主引用文献Crystal structure of Human Menin in complex with BD-08
To Be Published
7O9X
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Crystal structure of Human Menin with fragment 16
分子名称: (2-methoxyphenyl)methanamine, 1,2-ETHANEDIOL, GLYCEROL, ...
著者Groves, M.R, Gao, K.
登録日2021-04-17
公開日2022-07-27
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.299 Å)
主引用文献Crystal structure of Human Menin with fragment 16
To Be Published
7OA9
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Crystal structure of Human Menin in complex with Fragment 21
分子名称: (~{E})-2-cyano-3-(4-hydroxyphenyl)-~{N}-(2-morpholin-4-ylethyl)prop-2-enamide, 1,2-ETHANEDIOL, GLYCEROL, ...
著者Groves, M.R, Gao, K.
登録日2021-04-19
公開日2022-08-03
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.098 Å)
主引用文献Crystal structure of Human Menin in complex with Fragment 21
To Be Published
6SKV
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Crystal structure of bovine carbonic anhydrase II in complex with a benzenesulfonamide-based ligand (SH2)
分子名称: COPPER (II) ION, Carbonic anhydrase 2, GLYCEROL, ...
著者Groves, M.R, Wang, W, van Oosterwijk, N.
登録日2019-08-16
公開日2020-08-26
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Target diazotransfer reagents to label metalloenzymes
To Be Published
6SKT
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Crystal structure of bovine carbonic anhydrase II in complex with a benzenesulfonamide-based ligand (SH0)
分子名称: COPPER (II) ION, Carbonic anhydrase 2, GLYCEROL, ...
著者Groves, M.R, Wang, W, van Oosterwijk, N.
登録日2019-08-16
公開日2020-08-26
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Target diazotransfer reagents to label metalloenzymes
To Be Published
6S2K
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Human Menin in complex with AJ21
分子名称: Multiple endocrine neoplasia I, isoform CRA_b, ~{N}-[2-(4-methoxyphenyl)ethyl]-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine
著者Groves, M.R, Gao, K.
登録日2019-06-21
公開日2021-01-13
最終更新日2024-05-15
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献Human Menin in complex with AJ21
To Be Published
6SU9
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Crystal structure of Plasmodium falciparum PdxK with ligands AMP-PNP and PL
分子名称: 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE, MAGNESIUM ION, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, ...
著者Groves, M.R, Gao, K, Wang, W.
登録日2019-09-13
公開日2019-10-23
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Crystal structure of Plasmodium falciparum PdxK with ligands AMP-PNP and PL.
Crystals, 2019
6SKS
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Crystal structure of bovine carbonic anhydrase II in complex with a benzenesulfonamide-based ligand (SH1)
分子名称: COPPER (II) ION, Carbonic anhydrase 2, GLYCEROL, ...
著者Groves, M.R, Wang, W, van Oosterwijk, N.
登録日2019-08-16
公開日2020-08-26
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Target diazotransfer reagents to label metalloenzymes
To Be Published
8R2H
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BU of 8r2h by Molmil
Cryo-EM structure of 1-deoxy-D-xylulose 5-phosphate synthase (DXPS) from Plasmodium falciparum
分子名称: 1-deoxy-D-xylulose-5-phosphate synthase, MAGNESIUM ION, THIAMINE DIPHOSPHATE
著者Gawriljuk, V.O, Godoy, A.S, Oerlemans, R, Groves, M.R.
登録日2023-11-06
公開日2024-06-12
最終更新日2024-08-14
実験手法ELECTRON MICROSCOPY (2.42 Å)
主引用文献Cryo-EM structure of 1-deoxy-D-xylulose 5-phosphate synthase DXPS from Plasmodium falciparum reveals a distinct N-terminal domain.
Nat Commun, 15, 2024
6ZRT
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Crystal structure of SARS CoV2 main protease in complex with inhibitor Telaprevir
分子名称: (1S,3aR,6aS)-2-[(2S)-2-({(2S)-2-cyclohexyl-2-[(pyrazin-2-ylcarbonyl)amino]acetyl}amino)-3,3-dimethylbutanoyl]-N-[(2R,3S)-1-(cyclopropylamino)-2-hydroxy-1-oxohexan-3-yl]octahydrocyclopenta[c]pyrrole-1-carboxamide, DIMETHYL SULFOXIDE, Main Protease
著者Oerlemans, R, Wang, W, Lunev, S, Domling, A, Groves, M.R.
登録日2020-07-14
公開日2020-08-12
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Repurposing the HCV NS3-4A protease drug boceprevir as COVID-19 therapeutics.
Rsc Med Chem, 12, 2020
8Q5Z
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Crystal structure of bovine Thiosulfate sulfurtransferase
分子名称: SODIUM ION, Thiosulfate sulfurtransferase
著者Goor, H.v, Groves, M.R, AL-Dahmani, Z.M, Wang, C.
登録日2023-08-10
公開日2023-09-20
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Crystal structure of bovine Thiosulfate sulfurtransferase
To Be Published
6FBA
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Crystal Structure of truncated aspartate transcarbamoylase from Plasmodium falciparum with bound inhibitor 2,3-naphthalenediol
分子名称: Aspartate transcarbamoylase, DI(HYDROXYETHYL)ETHER, DIMETHYL SULFOXIDE, ...
著者Lunev, S, Bosch, S.S, Batista, F.A, Wang, C, Wrenger, C, Groves, M.R.
登録日2017-12-18
公開日2018-02-21
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Identification of a non-competitive inhibitor of Plasmodium falciparum aspartate transcarbamoylase.
Biochem. Biophys. Res. Commun., 497, 2018
6HL7
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Crystal structure of truncated aspartate transcarbamoylase from Plasmodium falciparum with mutated active site (R109A/K138A) and N-carbamoyl-L-phosphate bound
分子名称: Aspartate transcarbamoylase, PHOSPHORIC ACID MONO(FORMAMIDE)ESTER
著者Bosch, S.S, Lunev, S, Wrenger, C, Groves, M.R.
登録日2018-09-10
公開日2018-09-26
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Molecular Target Validation of Aspartate Transcarbamoylase fromPlasmodium falciparumby Torin 2.
Acs Infect Dis., 6, 2020
2W9Y
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The structure of the lipid binding protein Ce-FAR-7 from Caenorhabditis elegans
分子名称: FATTY ACID/RETINOL BINDING PROTEIN PROTEIN 7, ISOFORM A, CONFIRMED BY TRANSCRIPT EVIDENCE, ...
著者Jordanova, R, Groves, M.R, Tucker, P.A.
登録日2009-01-30
公開日2009-10-20
最終更新日2015-04-29
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Fatty Acid and Retinoid Binding Proteins Have Distinct Binding Pockets for the Two Types of Cargo
J.Biol.Chem., 284, 2009
4BMW
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Crystal structure of the Streptomyces reticuli HbpS E78D, E81D double mutant
分子名称: EXTRACELLULAR HAEM-BINDING PROTEIN
著者Wagener, S, Kursula, I, Wedderhoff, I, Groves, M.R, Ortiz de Orue Lucana, D.
登録日2013-05-11
公開日2013-09-25
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.99 Å)
主引用文献Iron Binding at Specific Sites within the Octameric Hbps Protects Streptomycetes from Iron-Mediated Oxidative Stress.
Plos One, 8, 2013

 

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