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6S11
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CRYSTAL STRUCTURE OF DYRK1A WITH SMALL MOLECULE INHIBITOR
Descriptor:Dual specificity tyrosine-phosphorylation-regulated kinase 1A, CHLORIDE ION, 6-pyridin-4-yl-3-[3-(trifluoromethyloxy)phenyl]imidazo[1,2-b]pyridazine
Authors:Sorrell, F.J., Henderson, S.H., Redondo, C., Burgess-Brown, N.A., von Delft, F., Arrowsmith, C.H., Bountra, C., Edwards, A.M., Elkins, J.M.
Deposit date:2019-06-18
Release date:2019-06-26
Method:X-RAY DIFFRACTION (2.445 Å)
Cite:Kinase Scaffold Repurposing in the Public Domain
To be published
6S14
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CRYSTAL STRUCTURE OF DYRK1A WITH SMALL MOLECULE INHIBITOR
Descriptor:Dual specificity tyrosine-phosphorylation-regulated kinase 1A, SULFATE ION, ~{N}-cyclopropyl-~{N}-methyl-4-pyrazolo[1,5-b]pyridazin-3-yl-pyrimidin-2-amine
Authors:Sorrell, F.J., Henderson, S.H., Redondo, C., Burgess-Brown, N.A., von Delft, F., Arrowsmith, C.H., Bountra, C., Edwards, A.M., Elkins, J.M.
Deposit date:2019-06-18
Release date:2019-06-26
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:Kinase Scaffold Repurposing in the Public Domain
To be published
6S17
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CRYSTAL STRUCTURE OF DYRK1A WITH SMALL MOLECULE INHIBITOR
Descriptor:Dual specificity tyrosine-phosphorylation-regulated kinase 1A, SULFATE ION, 1,2-ETHANEDIOL, ...
Authors:Sorrell, F.J., Henderson, S.H., Redondo, C., Burgess-Brown, N.A., von Delft, F., Arrowsmith, C.H., Bountra, C., Edwards, A.M., Elkins, J.M.
Deposit date:2019-06-18
Release date:2019-06-26
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Kinase Scaffold Repurposing in the Public Domain
To be published
6S1B
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CRYSTAL STRUCTURE OF DYRK1A WITH SMALL MOLECULE INHIBITOR
Descriptor:Dual specificity tyrosine-phosphorylation-regulated kinase 1A, SULFATE ION, ~{N}-methyl-4-pyrazolo[1,5-b]pyridazin-3-yl-pyrimidin-2-amine, ...
Authors:Sorrell, F.J., Henderson, S.H., Redondo, C., Burgess-Brown, N.A., von Delft, F., Arrowsmith, C.H., Bountra, C., Edwards, A.M., Elkins, J.M.
Deposit date:2019-06-18
Release date:2019-06-26
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Kinase Scaffold Repurposing in the Public Domain
To be published
6S1H
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CRYSTAL STRUCTURE OF DYRK1A WITH SMALL MOLECULE INHIBITOR
Descriptor:Dual specificity tyrosine-phosphorylation-regulated kinase 1A, SULFATE ION, ~{N},~{N}-dimethyl-4-(1~{H}-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine, ...
Authors:Sorrell, F.J., Henderson, S.H., Redondo, C., Burgess-Brown, N.A., von Delft, F., Arrowsmith, C.H., Bountra, C., Edwards, A.M., Elkins, J.M.
Deposit date:2019-06-18
Release date:2019-06-26
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:Kinase Scaffold Repurposing in the Public Domain
To be published
6S1I
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CRYSTAL STRUCTURE OF DYRK1A WITH SMALL MOLECULE INHIBITOR
Descriptor:Dual specificity tyrosine-phosphorylation-regulated kinase 1A, SULFATE ION, TETRAETHYLENE GLYCOL, ...
Authors:Sorrell, F.J., Henderson, S.H., Redondo, C., Burgess-Brown, N.A., von Delft, F., Arrowsmith, C.H., Bountra, C., Edwards, A.M., Elkins, J.M.
Deposit date:2019-06-18
Release date:2019-06-26
Method:X-RAY DIFFRACTION (2.38 Å)
Cite:Kinase Scaffold Repurposing in the Public Domain
To be published
6S1J
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CRYSTAL STRUCTURE OF DYRK1A WITH SMALL MOLECULE INHIBITOR
Descriptor:Dual specificity tyrosine-phosphorylation-regulated kinase 1A, 3-[2-[(3~{S})-3-fluoranylpyrrolidin-1-yl]pyrimidin-4-yl]pyrazolo[1,5-b]pyridazine, 1,2-ETHANEDIOL, ...
Authors:Sorrell, F.J., Henderson, S.H., Redondo, C., Burgess-Brown, N.A., von Delft, F., Arrowsmith, C.H., Bountra, C., Edwards, A.M., Elkins, J.M.
Deposit date:2019-06-18
Release date:2019-06-26
Method:X-RAY DIFFRACTION (1.408 Å)
Cite:Kinase Scaffold Repurposing in the Public Domain
To be published
6PBR
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CATALYTIC DOMAIN OF E.COLI DIHYDROLIPOAMIDE SUCCINYLTRANSFERASE IN I4 SPACE GROUP
Descriptor:Dihydrolipoyllysine-residue succinyltransferase component of 2-oxoglutarate dehydrogenase complex, SODIUM ION
Authors:Andi, B., Soares, A., Shi, W., McSweeney, S., Liu, Q.
Deposit date:2019-06-14
Release date:2019-06-26
Method:X-RAY DIFFRACTION (3 Å)
Cite:Structure of the dihydrolipoamide succinyltransferase catalytic domain from Escherichia coli in a novel crystal form: a tale of a common protein crystallization contaminant
To Be Published
6S07
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STRUCTURE OF FORMYLGLYCINE-GENERATING ENZYME AT 1.04 A IN COMPLEX WITH COPPER AND SUBSTRATE REVEALS AN ACIDIC POCKET FOR BINDING AND ACTI-VATION OF MOLECULAR OXYGEN.
Descriptor:Formylglycine-generating enzyme, Abz-ALA-THR-THR-PRO-LEU-CYS-GLY-PRO-SER-ARG-ALA-SER-ILE-LEU-SER-GLY-ARG, COPPER (I) ION, ...
Authors:Leisinger, F., Miarzlou, D.A., Seebeck, F.P.
Deposit date:2019-06-14
Release date:2019-06-26
Method:X-RAY DIFFRACTION (1.04 Å)
Cite:Structure of formylglycine-generating enzyme in complex with copper and a substrate reveals an acidic pocket for binding and activation of molecular oxygen
Chem Sci, 2019
6PBG
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CRYSTAL STRUCTURE OF WD-REPEAT DOMAIN OF HUMAN COATOMER SUBUNIT ALPHA (COPA)
Descriptor:Coatomer subunit alpha, L(+)-TARTARIC ACID, UNKNOWN ATOM OR ION
Authors:Halabelian, L., Zeng, H., Dong, A., Loppnau, P., Seitova, A., Hutchinson, A., Bountra, C., Edwards, A.M., Arrowsmith, C.H., Structural Genomics Consortium (SGC)
Deposit date:2019-06-13
Release date:2019-06-26
Method:X-RAY DIFFRACTION (1.72 Å)
Cite:Crystal structure of W repeat domain of human coatomer subunit Alpha (COPA)
to be published
6RZZ
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CRYO-EM STRUCTURES OF LSG1-TAP PRE-60S RIBOSOMAL PARTICLES
Descriptor:25S ribosomal RNA, 60S ribosomal protein L2-A, 60S ribosomal protein L3, ...
Authors:Kargas, V., Warren, A.J.
Deposit date:2019-06-13
Release date:2019-06-26
Method:ELECTRON MICROSCOPY (3.2 Å)
Cite:Cryo-EM structures of Lsg1-TAP pre-60S ribosomal particles
To Be Published
6S05
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CRYO-EM STRUCTURES OF LSG1-TAP PRE-60S RIBOSOMAL PARTICLES
Descriptor:25S ribosomal RNA, 60S ribosomal protein L2-A, 60S ribosomal protein L3, ...
Authors:Kargas, V., Warren, A.J.
Deposit date:2019-06-13
Release date:2019-06-26
Method:ELECTRON MICROSCOPY (3.9 Å)
Cite:Cryo-EM structures of Lsg1-TAP pre-60S ribosomal particles
To Be Published
6RYS
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ENGINEERED BETA-LACTOGLOBULIN: VARIANT F105L
Descriptor:Beta-lactoglobulin
Authors:Loch, J.I., Gotkowski, M., Lewinski, K.
Deposit date:2019-06-11
Release date:2019-06-26
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Engineered beta-lactoglobulin: variant F105L
To Be Published
6RYT
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ENGINEERED BETA-LACTOGLOBULIN: VARIANT M107L
Descriptor:Beta-lactoglobulin, GLYCEROL, PHOSPHATE ION
Authors:Loch, J.I., Kurpiewska, K., Lewinski, K.
Deposit date:2019-06-11
Release date:2019-06-26
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Engineered beta-lactoglobulin: variant M107L
To Be Published
6P9E
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CRYSTAL STRUCTURE OF IL-36GAMMA COMPLEXED TO A-552
Descriptor:Interleukin-36 gamma, (2S)-2-{[4-(3-amino-4-methylphenyl)-6-methylpyrimidin-2-yl]oxy}-3-methoxy-3,3-diphenylpropanoic acid
Authors:Argiriadi, M.A., Todorovic, T., Su, Z., Putman, B., Kakavas, S.J., Salte, K.M., McDonald, H.A., Wetter, J.B., Paulsboe, S.E., Sun, Q., Gerstein, C.E., Medina, L., Sielaff, B., Sadhukhan, R., Stockmann, H., Richardson, P.L., Qiu, W., Henry, R.F., Herold, J.M., Shotwell, J.B., McGaraughty, S.P., Honore, P., Gopalakrishnan, S.M., Sun, C.C., Scott, V.E.
Deposit date:2019-06-10
Release date:2019-06-26
Method:X-RAY DIFFRACTION (2 Å)
Cite:Small Molecule IL-36gamma Antagonist as a Novel Therapeutic Approach for Plaque Psoriasis
To be published
6P7I
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CRYSTAL STRUCTURE OF HUMAN PRMT6 IN COMPLEX WITH S-ADENOSYL-L-HOMOCYSTEINE AND YS17-117 COMPOUND
Descriptor:Protein arginine N-methyltransferase 6, S-ADENOSYL-L-HOMOCYSTEINE, N-[3-(4-{[(2-aminoethyl)(methyl)amino]methyl}-1H-pyrrol-3-yl)phenyl]prop-2-enamide, ...
Authors:Halabelian, L., Dong, A., Zeng, H., Li, Y., Seitova, A., Hutchinson, A., Bountra, C., Edwards, A.M., Arrowsmith, C.H., Brown, P.J., Structural Genomics Consortium (SGC)
Deposit date:2019-06-05
Release date:2019-06-26
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal structure of Human PRMT6 in complex with S-Adenosyl-L-Homocysteine and YS17-117 Comp ound
to be published
6RWP
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ENGINEERED BETA-LACTOGLOBULIN: VARIANT L58F IN COMPLEX WITH MYRISTIC ACID
Descriptor:Beta-lactoglobulin, MYRISTIC ACID, SULFATE ION
Authors:Loch, J.I., Kaczor, K., Lewinski, K.
Deposit date:2019-06-05
Release date:2019-06-19
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Engineered beta-lactoglobulin: variant L58F in complex with myristic acid
To Be Published
6RWQ
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ENGINEERED BETA-LACTOGLOBULIN: VARIANT F105L IN COMPLEX WITH MYRISTIC ACID
Descriptor:Beta-lactoglobulin, MYRISTIC ACID, 1,2-ETHANEDIOL
Authors:Loch, J.I., Gotkowski, M., Lewinski, K.
Deposit date:2019-06-05
Release date:2019-06-19
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Engineered beta-lactoglobulin: variant F105L in complex with myristic acid
To Be Published
6RWR
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ENGINEERED BETA-LACTOGLOBULIN: VARIANT M107L IN COMPLEX WITH MYRISTIC ACID
Descriptor:Beta-lactoglobulin, MYRISTIC ACID
Authors:Loch, J.I., Gotkowski, M., Lewinski, K.
Deposit date:2019-06-05
Release date:2019-06-19
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Engineered beta-lactoglobulin: variant M107L in complex with myristic acid
To Be Published
6P70
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X-RAY CRYSTAL STRUCTURE OF BACTERIAL RNA POLYMERASE AND PYRBI PROMOTER COMPLEX
Descriptor:DNA-directed RNA polymerase subunit alpha, DNA-directed RNA polymerase subunit beta, DNA-directed RNA polymerase subunit beta', ...
Authors:Shin, Y., Murakami, K.S.
Deposit date:2019-06-04
Release date:2019-06-19
Method:X-RAY DIFFRACTION (3.052 Å)
Cite:Structural basis of reiterative transcription from the pyrG promoter
To Be Published
6RWD
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CRYSTAL STRUCTURE OF SJGST IN COMPLEX WITH GSH AND ELLAGIC ACID AT 1.53 ANGSTROM RESOLUTION
Descriptor:Glutathione S-transferase class-mu 26 kDa isozyme, GLUTATHIONE, SODIUM ION, ...
Authors:Olfsen, J., Pandian, R., Sayed, Y., Dirr, H.W., Achilonu, I.A.
Deposit date:2019-06-04
Release date:2019-06-19
Method:X-RAY DIFFRACTION (1.53 Å)
Cite:Molecular basis of the inhibition of Schistosoma japonicum glutathione transferase by ellagic acid: insights into structure and biophysical studies
To Be Published
6P68
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CRYSTAL STRUCTURE OF FGFR1-Y563C (FGFR4 SURROGATE) COVALENTLY BOUND TO COMPOUND 22.
Descriptor:Fibroblast growth factor receptor 1, N-{3-[(6-{[(2,6-dichloro-3,5-dimethoxyphenyl)carbamoyl](methyl)amino}pyrimidin-4-yl)amino]-1-(2-hydroxyethyl)-1H-pyrazol-4-yl}prop-2-enamide, SULFATE ION
Authors:Larsen, N.A.
Deposit date:2019-06-03
Release date:2019-06-19
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:To be published
To Be Published
6P69
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CRYSTAL STRUCTURE OF FGFR1-Y563C (FGFR4 SURROGATE) COVALENTLY BOUND TO COMPOUND 11.
Descriptor:Fibroblast growth factor receptor 1, SULFATE ION, 1,2-ETHANEDIOL, ...
Authors:Larsen, N.A.
Deposit date:2019-06-03
Release date:2019-06-19
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:To be published
TBD
6P6F
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BG505 SOSIP-I53-50NP
Descriptor:I53-50A.1NT1, I53-50B.4PT1
Authors:Berndsen, Z.T., Ward, A.B.
Deposit date:2019-06-03
Release date:2019-06-19
Method:ELECTRON MICROSCOPY (4.5 Å)
Cite:Enhancing and shaping the immunogenicity of native-like HIV-1 envelope trimers by presentation on a two-component protein nanoparticle
To be Published
6RVV
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STRUCTURE OF LEFT-HANDED PROTEIN CAGE CONSISTING OF 24 ELEVEN-MEMBERED RING PROTEINS HELD TOGETHER BY GOLD (I) BRIDGES.
Descriptor:Transcription attenuation protein MtrB, GOLD ION
Authors:Malay, A.D., Miyazaki, N., Biela, A.P., Iwasaki, K., Heddle, J.G.
Deposit date:2019-06-03
Release date:2019-06-12
Method:ELECTRON MICROSCOPY (3.7 Å)
Cite:An ultra-stable gold-coordinated protein cage displaying reversible assembly.
Nature, 569, 2019