Structural Genomics Consortium,
Centre for Medicines Discovery
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Crystal structure of the 2-oxoglutarate- and Fe(II)-dependent lysyl hydroxylase JMJD6.
Journal of molecular biology Aug, 2010 | Pubmed ID: 20684070
Crystal Structure of the 2-Oxoglutarate- and Fe(II)-Dependent Lysyl Hydroxylase JMJD6.
Journal of molecular biology May, 2010 | Pubmed ID: 20685276
Structural and mechanistic studies on γ-butyrobetaine hydroxylase.
Chemistry & biology Dec, 2010 | Pubmed ID: 21168767
Crystal structures of the endoplasmic reticulum aminopeptidase-1 (ERAP1) reveal the molecular basis for N-terminal peptide trimming.
Proceedings of the National Academy of Sciences of the United States of America May, 2011 | Pubmed ID: 21508329
Assessment of radiation damage behaviour in a large collection of empirically optimized datasets highlights the importance of unmeasured complicating effects.
Journal of synchrotron radiation May, 2011 | Pubmed ID: 21525647
Structure of MMACHC reveals an arginine-rich pocket and a domain-swapped dimer for its B12 processing function.
Biochemistry Jun, 2012 | Pubmed ID: 22642810
Plant growth regulator daminozide is a selective inhibitor of human KDM2/7 histone demethylases.
Journal of medicinal chemistry Jul, 2012 | Pubmed ID: 22724510
Structural basis for Cul3 protein assembly with the BTB-Kelch family of E3 ubiquitin ligases.
The Journal of biological chemistry Mar, 2013 | Pubmed ID: 23349464
Crystal structures of malonyl-coenzyme A decarboxylase provide insights into its catalytic mechanism and disease-causing mutations.
Structure (London, England : 1993) Jul, 2013 | Pubmed ID: 23791943
Ribosomal oxygenases are structurally conserved from prokaryotes to humans.
Nature Jun, 2014 | Pubmed ID: 24814345
Lysine methylation-dependent binding of 53BP1 to the pRb tumor suppressor.
Proceedings of the National Academy of Sciences of the United States of America Aug, 2014 | Pubmed ID: 25049398
Structural basis of glycogen branching enzyme deficiency and pharmacologic rescue by rational peptide design.
Human molecular genetics Oct, 2015 | Pubmed ID: 26199317
Optimisation of a triazolopyridine based histone demethylase inhibitor yields a potent and selective KDM2A (FBXL11) inhibitor.
MedChemComm Dec, 2014 | Pubmed ID: 26682034
5-Carboxy-8-hydroxyquinoline is a Broad Spectrum 2-Oxoglutarate Oxygenase Inhibitor which Causes Iron Translocation.
Chemical science Aug, 2013 | Pubmed ID: 26682036
Human ISPD Is a Cytidyltransferase Required for Dystroglycan O-Mannosylation.
Chemistry & biology Dec, 2015 | Pubmed ID: 26687144
Docking and Linking of Fragments To Discover Jumonji Histone Demethylase Inhibitors.
Journal of medicinal chemistry Feb, 2016 | Pubmed ID: 26699912
8-Substituted Pyrido[3,4-d]pyrimidin-4(3H)-one Derivatives As Potent, Cell Permeable, KDM4 (JMJD2) and KDM5 (JARID1) Histone Lysine Demethylase Inhibitors.
Journal of medicinal chemistry Feb, 2016 | Pubmed ID: 26741168
An overview of heavy-atom derivatization of protein crystals.
Acta crystallographica. Section D, Structural biology Mar, 2016 | Pubmed ID: 26960118
Outcome of the First wwPDB/CCDC/D3R Ligand Validation Workshop.
Structure (London, England : 1993) Apr, 2016 | Pubmed ID: 27050687
A generic protocol for protein crystal dehydration using the HC1b humidity controller.
Acta crystallographica. Section D, Structural biology 05, 2016 | Pubmed ID: 27139626
Multivalent Histone and DNA Engagement by a PHD/BRD/PWWP Triple Reader Cassette Recruits ZMYND8 to K14ac-Rich Chromatin.
Cell reports 12, 2016 | Pubmed ID: 27926874
Structure and inhibitor specificity of the PCTAIRE-family kinase CDK16.
The Biochemical journal 02, 2017 | Pubmed ID: 28057719
Gentle, fast and effective crystal soaking by acoustic dispensing.
Acta crystallographica. Section D, Structural biology 03, 2017 | Pubmed ID: 28291760
Proper modelling of ligand binding requires an ensemble of bound and unbound states.
Acta crystallographica. Section D, Structural biology 03, 2017 | Pubmed ID: 28291761
The XChemExplorer graphical workflow tool for routine or large-scale protein-ligand structure determination.
Acta crystallographica. Section D, Structural biology 03, 2017 | Pubmed ID: 28291762
Partial-occupancy binders identified by the Pan-Dataset Density Analysis method offer new chemical opportunities and reveal cryptic binding sites.
Structural dynamics (Melville, N.Y.) May, 2017 | Pubmed ID: 28345007
A multi-crystal method for extracting obscured crystallographic states from conventionally uninterpretable electron density.
Nature communications 04, 2017 | Pubmed ID: 28436492
A poised fragment library enables rapid synthetic expansion yielding the first reported inhibitors of PHIP(2), an atypical bromodomain.
Chemical science Mar, 2016 | Pubmed ID: 29910922
Achieving a Good Crystal System for Crystallographic X-Ray Fragment Screening.
Methods in enzymology , 2018 | Pubmed ID: 30390801
A Parsimonious Mechanism of Sugar Dehydration by Human GDP-Mannose-4,6-dehydratase.
ACS catalysis Apr, 2019 | Pubmed ID: 30984471
Rapid Covalent-Probe Discovery by Electrophile-Fragment Screening.
Journal of the American Chemical Society 06, 2019 | Pubmed ID: 31060360
Aspartate/asparagine-β-hydroxylase crystal structures reveal an unexpected epidermal growth factor-like domain substrate disulfide pattern.
Nature communications 10, 2019 | Pubmed ID: 31659163
Deliberately Losing Control of C-H Activation Processes in the Design of Small-Molecule-Fragment Arrays Targeting Peroxisomal Metabolism.
ChemMedChem Dec, 2020 | Pubmed ID: 32812371
Crystallographic and electrophilic fragment screening of the SARS-CoV-2 main protease.
Nature communications 10, 2020 | Pubmed ID: 33028810
Discovery of allosteric binding sites by crystallographic fragment screening.
Current opinion in structural biology 12, 2020 | Pubmed ID: 33171388
Fragment Binding to the Nsp3 Macrodomain of SARS-CoV-2 Identified Through Crystallographic Screening and Computational Docking.
bioRxiv : the preprint server for biology Nov, 2020 | Pubmed ID: 33269349
The low-cost Shifter microscope stage transforms the speed and robustness of protein crystal harvesting.
Acta crystallographica. Section D, Structural biology Jan, 2021 | Pubmed ID: 33404526
Fragment Screening Reveals Starting Points for Rational Design of Galactokinase 1 Inhibitors to Treat Classic Galactosemia.
ACS chemical biology 04, 2021 | Pubmed ID: 33724769
Structure and activation mechanism of the human liver-type glutaminase GLS2.
Biochimie Jun, 2021 | Pubmed ID: 33746066
Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking.
Science advances 04, 2021 | Pubmed ID: 33853786
Alice Douangamath*,1,2,
Ailsa Powell*,1,2,
Daren Fearon*,1,2,
Patrick M. Collins1,2,
Romain Talon1,2,3,
Tobias Krojer3,4,
Rachael Skyner1,2,
Jose Brandao-Neto1,2,
Louise Dunnett1,2,
Alexandre Dias1,2,
Anthony Aimon1,2,3,
Nicholas M. Pearce1,3,
Conor Wild3,5,
Tyler Gorrie-Stone1,
Frank von Delft1,2,3,4,6
1, Diamond Light Source Ltd, Harwell Science and Innovation Campus,
2, Research Complex at Harwell, Harwell Science and Innovation Campus,
3Structural Genomics Consortium, University of Oxford,
4Centre for Medicines Discovery, University of Oxford,
5Oxford Protein Informatics Group, Department of Statistics, Oxford University,
6Department of Biochemistry, University of Johannesburg
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