Entry | Database: PDB / ID: 4uy1 |
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Title | Novel pyrazole series of group X Secretory Phospholipase A2 (sPLA2-X) inhibitors |
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Components | GROUP 10 SECRETORY PHOSPHOLIPASE A2 |
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Keywords | HYDROLASE / FRAGMENT BASED LEAD GENERATION / VIRTUAL SCREENING / DRUG DISCOVERY |
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Function / homology | Function and homology information
phosphatidylserine metabolic process / lysophospholipid transport / phosphatidylethanolamine metabolic process / phosphatidic acid metabolic process / production of molecular mediator involved in inflammatory response / platelet activating factor catabolic process / positive regulation of acrosome reaction / Acyl chain remodelling of PG / intestinal stem cell homeostasis / Acyl chain remodelling of PC ...phosphatidylserine metabolic process / lysophospholipid transport / phosphatidylethanolamine metabolic process / phosphatidic acid metabolic process / production of molecular mediator involved in inflammatory response / platelet activating factor catabolic process / positive regulation of acrosome reaction / Acyl chain remodelling of PG / intestinal stem cell homeostasis / Acyl chain remodelling of PC / Acyl chain remodelling of PI / phospholipase activity / Acyl chain remodelling of PS / Acyl chain remodelling of PE / 1-alkyl-2-acetylglycerophosphocholine esterase activity / Synthesis of PA / negative regulation of cholesterol efflux / phosphatidylglycerol metabolic process / arachidonic acid metabolic process / phosphatidylcholine catabolic process / phosphatidylcholine metabolic process / positive regulation of prostaglandin secretion / phospholipase A2 activity / positive regulation of macrophage derived foam cell differentiation / positive regulation of lipid storage / macrophage activation / positive regulation of arachidonic acid secretion / low-density lipoprotein particle remodeling / fertilization / calcium-dependent phospholipase A2 activity / phospholipase A2 / prostaglandin biosynthetic process / regulation of macrophage activation / arachidonic acid secretion / hair follicle morphogenesis / erythrocyte maturation / negative regulation of cytokine production involved in inflammatory response / phospholipid metabolic process / positive regulation of protein metabolic process / acrosomal vesicle / cellular response to leukemia inhibitory factor / cholesterol homeostasis / axon guidance / negative regulation of DNA-binding transcription factor activity / phospholipid binding / negative regulation of inflammatory response / defense response to virus / lysosome / calcium ion binding / extracellular space / extracellular regionSimilarity search - Function Phospholipase A2, aspartic acid active site / Phospholipase A2 aspartic acid active site. / Phospholipase A2 / Phospholipase A2, histidine active site / Phospholipase A2 histidine active site. / Phospholipase A2 / Phospholipase A2 domain / Phospholipase A2 / Phospholipase A2 / Phospholipase A2 domain ...Phospholipase A2, aspartic acid active site / Phospholipase A2 aspartic acid active site. / Phospholipase A2 / Phospholipase A2, histidine active site / Phospholipase A2 histidine active site. / Phospholipase A2 / Phospholipase A2 domain / Phospholipase A2 / Phospholipase A2 / Phospholipase A2 domain / Phospholipase A2 domain superfamily / Up-down Bundle / Mainly AlphaSimilarity search - Domain/homology |
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Biological species | HOMO SAPIENS (human) |
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Method | X-RAY DIFFRACTION / MOLECULAR REPLACEMENT / Resolution: 2.2 Å |
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Authors | Sandmark, J. / Oster, L. / Hallberg, K. / Bodin, C. / Chen, H. |
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Citation | Journal: Bioorg.Med.Chem.Lett. / Year: 2014 Title: Discovery of a Novel Pyrazole Series of Group X Secreted Phospholipase A2 Inhibitor (Spla2X) Via Fragment Based Virtual Screening Authors: Chen, H. / Knerr, L. / Akerud, T. / Hallberg, K. / Bodin, C. / Oster, L. / Rohman, M. / Osterlund, K. / Beisel, H.G. / Olsson, T. / Brengdhal, J. / Sandmark, J. |
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History | Deposition | Aug 28, 2014 | Deposition site: PDBE / Processing site: PDBE |
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Revision 1.0 | Oct 15, 2014 | Provider: repository / Type: Initial release |
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Revision 1.1 | Oct 29, 2014 | Group: Database references |
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Revision 1.2 | Dec 17, 2014 | Group: Database references |
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Revision 1.3 | Apr 4, 2018 | Group: Data collection / Category: diffrn_source / Item: _diffrn_source.type |
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