Author results

2WZ1
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STRUCTURE OF THE CATALYTIC DOMAIN OF HUMAN SOLUBLE GUANYLATE CYCLASE 1 BETA 3.
Descriptor:GUANYLATE CYCLASE SOLUBLE SUBUNIT BETA-1, 1,2-ETHANEDIOL
Authors:Allerston, C.K., Cooper, C.D.O., Muniz, J., Pike, A.C.W., von Delft, F., Arrowsmith, C.H., Weigelt, J., Edwards, A., Bountra, C., Gileadi, O.
Deposit date:2009-11-23
Release date:2009-12-01
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.63 Å)
Cite:Crystal Structures of the Catalytic Domain of Human Soluble Guanylate Cyclase.
Plos One, 8, 2013
3UVJ
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CRYSTAL STRUCTURE OF THE CATALYTIC DOMAIN OF THE HETERODIMERIC HUMAN SOLUBLE GUANYLATE CYCLASE 1.
Descriptor:Guanylate cyclase soluble subunit alpha-3, Guanylate cyclase soluble subunit beta-1, 1,2-ETHANEDIOL, ...
Authors:Allerston, C.K., Berridge, G., Chalk, R., Cooper, C.D.O., Savitsky, P., Vollmar, M., Arrowsmith, C.H., Weigelt, J., Edwards, A., Bountra, C., von Delft, F., Gileadi, O., Structural Genomics Consortium (SGC)
Deposit date:2011-11-30
Release date:2011-12-28
Last modified:2018-01-31
Method:X-RAY DIFFRACTION (2.08 Å)
Cite:Crystal structures of the catalytic domain of human soluble guanylate cyclase.
Plos One, 8, 2013
3ZWF
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CRYSTAL STRUCTURE OF HUMAN TRNASE Z, SHORT FORM (ELAC1).
Descriptor:ZINC PHOSPHODIESTERASE ELAC PROTEIN 1, 1,2-ETHANEDIOL, ZINC ION, ...
Authors:Allerston, C.K., Krojer, T., Berridge, G., Burgess-Brown, N., Chaikuad, A., Chalk, R., Elkins, J.M., Gileadi, C., Latwiel, S.V.A., Savitsky, P., Vollmar, M., Arrowsmith, C.H., Weigelt, J., Edwards, A., Bountra, C., von Delft, F., Gileadi, O.
Deposit date:2011-07-29
Release date:2011-08-10
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Crystal Structure of Human Trnase Z, Short Form (Elac1).
To be Published
4AD9
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CRYSTAL STRUCTURE OF HUMAN LACTB2.
Descriptor:BETA-LACTAMASE-LIKE PROTEIN 2, ZINC ION, 1,2-ETHANEDIOL
Authors:Allerston, C.K., Krojer, T., Shrestha, B., Burgess Brown, N., Chalk, R., Elkins, J.M., Filippakopoulos, P., Pike, A.C.W., Muniz, J.R.C., Vollmar, M., Arrowsmith, C.H., Weigelt, J., Edwards, A., Bountra, C., von Delft, F., Gileadi, O.
Deposit date:2011-12-22
Release date:2012-02-01
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Identification of Lactb2, a Metallo-Beta-Lactamase Protein, as a Human Mitochondrial Endoribonuclease
Nucleic Acids Res., 44, 2016
4ATM
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CRYSTAL STRUCTURE OF THE BAR DOMAIN OF HUMAN AMPHIPHYSIN, ISOFORM 1 AT 1.8 ANGSTROM RESOLUTION FEATURING INCREASED ORDER AT THE N- TERMINUS.
Descriptor:AMPHIPHYSIN, 1,2-ETHANEDIOL, GLYCEROL
Authors:Allerston, C.K., Krojer, T., Arrowsmith, C.H., Weigelt, J., Edwards, A., Bountra, C., von Delft, F., Gileadi, O.
Deposit date:2012-05-08
Release date:2012-05-30
Last modified:2012-12-05
Method:X-RAY DIFFRACTION (1.783 Å)
Cite:Crystal Structure of the Bar Domain of Human Amphiphysin, Isoform 1
To be Published
4AVM
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CRYSTAL STRUCTURE OF THE N-BAR DOMAIN OF HUMAN BRIDGING INTEGRATOR 2.
Descriptor:BRIDGING INTEGRATOR 2, 1,2-ETHANEDIOL, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID
Authors:Allerston, C.K., Krojer, T., Cooper, C.D.O., Vollmar, M., Arrowsmith, C.H., Edwards, A., Bountra, C., von Delft, F., Gileadi, O.
Deposit date:2012-05-28
Release date:2012-06-20
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.91 Å)
Cite:Crystal Structure of the N-Bar Domain of Human Bridging Integrator 2.
To be Published
4B4C
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CRYSTAL STRUCTURE OF THE DNA-BINDING DOMAIN OF HUMAN CHD1.
Descriptor:CHROMODOMAIN-HELICASE-DNA-BINDING PROTEIN 1, SULFATE ION, 1,2-ETHANEDIOL, ...
Authors:Allerston, C.K., Cooper, C.D.O., Shrestha, L., Vollmar, M., Burgess-Brown, N., Yue, W.W., Carpenter, E.P., Arrowsmith, C.H., Edwards, A., Bountra, C., von Delft, F., Gileadi, O.
Deposit date:2012-07-30
Release date:2012-08-15
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.62 Å)
Cite:Crystal Structure of the DNA-Binding Domain of Human Chd1.
To be Published
4B87
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CRYSTAL STRUCTURE OF HUMAN DNA CROSS-LINK REPAIR 1A
Descriptor:DNA CROSS-LINK REPAIR 1A PROTEIN, ZINC ION, 1,2-ETHANEDIOL
Authors:Allerston, C.K., Berridge, G., Carpenter, E.P., Kochan, G., Krojer, T., Mahajan, P., Vollmar, M., Yue, W.W., Arrowsmith, C.H., Edwards, A., Bountra, C., von Delft, F., Gileadi, O.
Deposit date:2012-08-24
Release date:2012-11-28
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.16 Å)
Cite:Crystal Structure of Human DNA Cross-Link Repair 1A
To be Published
4BBQ
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CRYSTAL STRUCTURE OF THE CXXC AND PHD DOMAIN OF HUMAN LYSINE-SPECIFIC DEMETHYLASE 2A (KDM2A)(FBXL11)
Descriptor:LYSINE-SPECIFIC DEMETHYLASE 2A, 1,2-ETHANEDIOL, ZINC ION
Authors:Allerston, C.K., Watson, A.A., Edlich, C., Li, B., Chen, Y., Ball, L., Krojer, T., Arrowsmith, C.H., Edwards, A., Bountra, C., von Delft, F., Laue, E.D., Gileadi, O.
Deposit date:2012-09-27
Release date:2012-10-10
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.24 Å)
Cite:Crystal Structure of the Cxxc and Phd Domain of Human Lysine-Specific Demethylase 2A (Kdm2A)(Fbxl11)
To be Published
4RN5
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B1 DOMAIN OF HUMAN NEUROPILIN-1 WITH ACETATE ION IN A LIGAND-BINDING SITE
Descriptor:Neuropilin-1, ACETATE ION, ZINC ION, ...
Authors:Allerston, C.K., Yelland, T.S., Jarvis, A., Jenkins, K., Winfield, N., Cheng, L., Jia, H., Zachary, I., Selwood, D.L., Djordjevic, S.
Deposit date:2014-10-23
Release date:2015-10-28
Method:X-RAY DIFFRACTION (1.73 Å)
Cite:Conserved water molecules in a ligand-binding site of neuropilin-1
To be Published
5AHO
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CRYSTAL STRUCTURE OF HUMAN 5' EXONUCLEASE APOLLO
Descriptor:5' EXONUCLEASE APOLLO, 1,2-ETHANEDIOL, L(+)-TARTARIC ACID, ...
Authors:Allerston, C.K., Vollmar, M., Krojer, T., Pike, A.C.W., Newman, J.A., Carpenter, E., Quigley, A., Mahajan, P., von Delft, F., Bountra, C., Arrowsmith, C.H., Edwards, A., Gileadi, O.
Deposit date:2015-02-06
Release date:2015-02-18
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.16 Å)
Cite:The Structures of the Snm1A and Snm1B/Apollo Nuclease Domains Reveal a Potential Basis for Their Distinct DNA Processing Activities.
Nucleic Acids Res., 43, 2015
5AHR
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CRYSTAL STRUCTURE OF HUMAN DNA CROSS-LINK REPAIR 1A, CRYSTAL FORM B
Descriptor:DNA CROSS-LINK REPAIR 1A PROTEIN, ZINC ION, 1,2-ETHANEDIOL
Authors:Allerston, C.K., Newman, J.A., Vollmar, M., Goubin, S., Forese, D.S., Chaikuad, A., von Delft, F., Arrowsmith, C.H., Edwards, A., Bountra, C., Gileadi, O.
Deposit date:2015-02-06
Release date:2015-02-18
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.19 Å)
Cite:The Structures of the Snm1A and Snm1B/Apollo Nuclease Domains Reveal a Potential Basis for Their Distinct DNA Processing Activities.
Nucleic Acids Res., 43, 2015
2YPR
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CRYSTAL STRUCTURE OF THE DNA BINDING ETS DOMAIN OF HUMAN PROTEIN FEV
Descriptor:PROTEIN FEV, GLYCEROL
Authors:Allerston, C.K., Cooper, C., Vollmar, M., Krojer, T., von Delft, F., Weigelt, J., Arrowsmith, C.H., Bountra, C., Edwards, A., Gileadi, O.
Deposit date:2012-10-31
Release date:2013-01-16
Last modified:2015-06-10
Method:X-RAY DIFFRACTION (2.64 Å)
Cite:Structures of the Ets Domains of Transcription Factors Etv1, Etv4, Etv5 and Fev: Determinants of DNA Binding and Redox Regulation by Disulfide Bond Formation.
J.Biol.Chem., 290, 2015
3I97
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B1 DOMAIN OF HUMAN NEUROPILIN-1 BOUND WITH SMALL MOLECULE EG00229
Descriptor:Neuropilin-1, (S)-2-(3-(benzo[c][1,2,5]thiadiazole-4-sulfonamido)thiophene-2-carboxamido)-5-guanidinopentanoic acid, GLYCEROL
Authors:Allerston, C.K., Djordjevic, S.
Deposit date:2009-07-10
Release date:2010-03-02
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Small molecule inhibitors of the neuropilin-1 vascular endothelial growth factor A (VEGF-A) interaction.
J.Med.Chem., 53, 2010
3OP5
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HUMAN VACCINIA-RELATED KINASE 1
Descriptor:Serine/threonine-protein kinase VRK1, [4-({4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl}amino)phenyl]acetonitrile, 1,2-ETHANEDIOL, ...
Authors:Allerston, C.K., Uttarkar, S., Savitsky, P., Elkins, J.M., Filippakopoulos, P., Krojer, T., Rellos, P., Fedorov, O., Eswaran, J., Brenner, B., Keates, T., Das, S., King, O., Chalk, R., Berridge, G., von Delft, F., Gileadi, O., Arrowsmith, C.H., Edwards, A.M., Weigelt, J., Bountra, C., Knapp, S., Structural Genomics Consortium (SGC)
Deposit date:2010-08-31
Release date:2010-09-22
Last modified:2019-01-30
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structural characterization of human Vaccinia-Related Kinases (VRK) bound to small-molecule inhibitors identifies different P-loop conformations.
Sci Rep, 7, 2017
4AVP
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CRYSTAL STRUCTURE OF THE DNA-BINDING DOMAIN OF HUMAN ETV1.
Descriptor:ETS TRANSLOCATION VARIANT 1, 1,2-ETHANEDIOL
Authors:Allerston, C.K., Cooper, C.D.O., Krojer, T., Chaikuad, A., Filippakopoulos, P., Canning, P., Arrowsmith, C.H., Edwards, A., Bountra, C., von Delft, F., Gileadi, O.
Deposit date:2012-05-28
Release date:2012-06-20
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.82 Å)
Cite:Structures of the Ets Domains of Transcription Factors Etv1, Etv4, Etv5 and Fev: Determinants of DNA Binding and Redox Regulation by Disulfide Bond Formation.
J.Biol.Chem., 290, 2015
4BNC
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CRYSTAL STRUCTURE OF THE DNA-BINDING DOMAIN OF HUMAN ETV1 COMPLEXED WITH DNA
Descriptor:HUMAN ETV1, 5'-D(*AP*CP*CP*GP*GP*AP*AP*GP*TP*GP)-3', 5'-D(*CP*AP*CP*TP*TP*CP*CP*GP*GP*TP)-3'
Authors:Allerston, C.K., Cooper, C.D.O., Krojer, T., Chaikuad, A., Vollmar, M., Froese, D.S., Arrowsmith, C.H., Edwards, A., Bountra, C., von Delft, F., Gileadi, O.
Deposit date:2013-05-14
Release date:2013-07-03
Last modified:2015-06-10
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Structures of the Ets Domains of Transcription Factors Etv1, Etv4, Etv5 and Fev: Determinants of DNA Binding and Redox Regulation by Disulfide Bond Formation.
J.Biol.Chem., 290, 2015
3S95
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CRYSTAL STRUCTURE OF THE HUMAN LIMK1 KINASE DOMAIN IN COMPLEX WITH STAUROSPORINE
Descriptor:LIM domain kinase 1, STAUROSPORINE, SODIUM ION, ...
Authors:Beltrami, A., Chaikuad, A., Daga, N., Elkins, J.M., Mahajan, P., Savitsky, P., Vollmar, M., Krojer, T., Muniz, J.R.C., Fedorov, O., Allerston, C.K., Yue, W.W., Gileadi, O., von Delft, F., Arrowsmith, C.H., Edwards, A.M., Weigelt, J., Bountra, C., Knapp, S., Bullock, A., Structural Genomics Consortium (SGC)
Deposit date:2011-05-31
Release date:2011-07-06
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Crystal structure of the human LIMK1 kinase domain in complex with staurosporine
To be Published
3ZP5
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CRYSTAL STRUCTURE OF THE DNA BINDING ETS DOMAIN OF THE HUMAN PROTEIN FEV IN COMPLEX WITH DNA
Descriptor:PROTEIN FEV, 5'-D(*CP*AP*CP*TP*TP*CP*CP*GP*GP*TP)-3', 5'-D(*AP*CP*CP*GP*GP*AP*AP*GP*TP*GP)-3'
Authors:Newman, J.A., Cooper, C.D.O., Krojer, T., Shrestha, L., Allerston, C.K., Vollmar, M., Arrowsmith, C.H., Burgess-Brown, N., Edwards, A., von Delft, F., Gileadi, O.
Deposit date:2013-02-26
Release date:2013-03-06
Last modified:2015-06-10
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structures of the Ets Domains of Transcription Factors Etv1, Etv4, Etv5 and Fev: Determinants of DNA Binding and Redox Regulation by Disulfide Bond Formation.
J.Biol.Chem., 290, 2015
4CDG
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CRYSTAL STRUCTURE OF THE BLOOM'S SYNDROME HELICASE BLM IN COMPLEX WITH NANOBODY
Descriptor:BLOOM SYNDROME PROTEIN, NANOBODY, ADENOSINE-5'-DIPHOSPHATE, ...
Authors:Newman, J.A., Savitsky, P., Allerston, C.K., Pike, A.C.W., Pardon, E., Steyaert, J., Arrowsmith, C.H., von Delft, F., Bountra, C., Edwards, A., Gileadi, O.
Deposit date:2013-10-31
Release date:2013-11-13
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.794 Å)
Cite:Crystal Structure of the Bloom'S Syndrome Helicase Indicates a Role for the Hrdc Domain in Conformational Changes.
Nucleic Acids Res., 43, 2015
4FR4
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CRYSTAL STRUCTURE OF HUMAN SERINE/THREONINE-PROTEIN KINASE 32A (YANK1)
Descriptor:Serine/threonine-protein kinase 32A, STAUROSPORINE, 1,2-ETHANEDIOL
Authors:Chaikuad, A., Elkins, J.M., Krojer, T., Mahajan, P., Goubin, S., Szklarz, M., Tumber, A., Wang, J., Savitsky, P., Shrestha, B., Daga, N., Picaud, S., Fedorov, O., Allerston, C.K., Latwiel, S.V.A., Vollmar, M., Canning, P., von Delft, F., Arrowsmith, C.H., Edwards, A.M., Bountra, C., Knapp, S., Structural Genomics Consortium (SGC)
Deposit date:2012-06-26
Release date:2012-07-18
Method:X-RAY DIFFRACTION (2.29 Å)
Cite:Crystal structure of human serine/threonine-protein kinase 32A (YANK1)
To be Published
4UUC
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CRYSTAL STRUCTURE OF HUMAN ASB11 ANKYRIN REPEAT DOMAIN
Descriptor:ANKYRIN REPEAT AND SOCS BOX PROTEIN 11
Authors:Pinkas, D.M., Sanvitale, C., Kragh Nielsen, T., Guo, K., Sorrell, F., Berridge, G., Ayinampudi, V., Wang, D., Newman, J.A., Tallant, C., Chaikuad, A., Canning, P., Kopec, J., Krojer, T., Vollmar, M., Allerston, C.K., Chalk, R., Burgess-Brown, N., von Delft, F., Arrowsmith, C.H., Edwards, A., Bountra, C., Bullock, A.
Deposit date:2014-07-25
Release date:2014-08-06
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal Structure of Human Asb11 Ankyrin Repeat Domain
To be Published
5UOY
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CRYSTAL STRUCTURE OF HUMAN PDE1B CATALYTIC DOMAIN IN COMPLEX WITH INHIBITOR 16J (6-(4-METHOXYBENZYL)-9-((TETRAHYDRO-2H-PYRAN-4-YL)METHYL)-8,9,10,11-TETRAHYDROPYRIDO[4',3':4,5]THIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-5(6H)-ONE)
Descriptor:Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B, ZINC ION, MAGNESIUM ION, ...
Authors:Cedervall, E.P., Allerston, C.K., Xu, R., Sridhar, V., Barker, R., Aertgeerts, K.
Deposit date:2017-02-01
Release date:2017-04-26
Last modified:2017-05-10
Method:X-RAY DIFFRACTION (1.82 Å)
Cite:Discovery of Selective Phosphodiesterase 1 Inhibitors with Memory Enhancing Properties.
J. Med. Chem., 60, 2017
5UP0
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CRYSTAL STRUCTURE OF HUMAN PDE1B CATALYTIC DOMAIN IN COMPLEX WITH INHIBITOR 3 (6-(4-CHLOROBENZYL)-8,9,10,11-TETRAHYDROBENZO[4,5]THIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-5(6H)-ONE)
Descriptor:Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B, ZINC ION, MAGNESIUM ION, ...
Authors:Cedervall, E.P., Allerston, C.K., Xu, R., Sridhar, V., Barker, R., Aertgeerts, K.
Deposit date:2017-02-01
Release date:2017-04-26
Last modified:2017-05-10
Method:X-RAY DIFFRACTION (2.04 Å)
Cite:Discovery of Selective Phosphodiesterase 1 Inhibitors with Memory Enhancing Properties.
J. Med. Chem., 60, 2017
3SOG
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CRYSTAL STRUCTURE OF THE BAR DOMAIN OF HUMAN AMPHIPHYSIN, ISOFORM 1
Descriptor:Amphiphysin, 1,2-ETHANEDIOL, POTASSIUM ION
Authors:Allerston, C.K., Krojer, T., Chaikuad, A., Cooper, C.D.O., Berridge, G., Savitsky, P., Vollmar, M., von Delft, F., Arrowsmith, C.H., Weigelt, J., Edwards, A., Bountra, C., Gileadi, O., Structural Genomics Consortium (SGC)
Deposit date:2011-06-30
Release date:2011-07-13
Last modified:2018-01-31
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:

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