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8DQT
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BU of 8dqt by Molmil
Human PDK1 kinase domain in complex with Valsartan
Descriptor: (2~{S})-3-methyl-2-[pentanoyl-[[4-[2-(2~{H}-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoic acid, 3-phosphoinositide-dependent protein kinase 1, GLYCEROL
Authors:Gross, L.Z.F, Klinke, S, Biondi, R.M.
Deposit date:2022-07-19
Release date:2023-06-21
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.31 Å)
Cite:Modulation of the substrate specificity of the kinase PDK1 by distinct conformations of the full-length protein.
Sci.Signal., 16, 2023
6SWO
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BU of 6swo by Molmil
C-TERMINAL BROMODOMAIN OF HUMAN BRD2 WITH iBET-BD1 (GSK778)
Descriptor: 1,2-ETHANEDIOL, 4-[2-(methoxymethyl)-1-[(1~{R})-1-phenylethyl]-8-[[(3~{S})-pyrrolidin-3-yl]methoxy]imidazo[4,5-c]quinolin-7-yl]-3,5-dimethyl-1,2-oxazole, Bromodomain-containing protein 2
Authors:Chung, C.
Deposit date:2019-09-22
Release date:2020-04-01
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (1.601 Å)
Cite:Selective targeting of BD1 and BD2 of the BET proteins in cancer and immunoinflammation.
Science, 368, 2020
8FP3
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BU of 8fp3 by Molmil
PKCeta kinase domain in complex with compound 11
Descriptor: (3P)-3-{4-[(3R,5S)-3-amino-5-methylpiperidin-1-yl]-6-chloro-7H-pyrrolo[2,3-d]pyrimidin-5-yl}benzonitrile, Protein kinase C eta type
Authors:Johnson, E.
Deposit date:2023-01-03
Release date:2023-04-05
Last modified:2023-04-26
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Design and Synthesis of Functionally Active 5-Amino-6-Aryl Pyrrolopyrimidine Inhibitors of Hematopoietic Progenitor Kinase 1.
J.Med.Chem., 66, 2023
8FP1
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BU of 8fp1 by Molmil
PKCeta kinase domain in complex with compound 2
Descriptor: (3P)-3-[6-chloro-4-(9-methyl-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzonitrile, Protein kinase C eta type
Authors:Johnson, E.
Deposit date:2023-01-03
Release date:2023-04-05
Last modified:2023-04-26
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Design and Synthesis of Functionally Active 5-Amino-6-Aryl Pyrrolopyrimidine Inhibitors of Hematopoietic Progenitor Kinase 1.
J.Med.Chem., 66, 2023
6QGI
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BU of 6qgi by Molmil
Crystal structure of VP5 from Haloarchaeal pleomorphic virus 2
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, VP5
Authors:El Omari, K, Walter, T.S, Harlos, K, Grimes, J.M, Stuart, D.I, Roine, E.
Deposit date:2019-01-11
Release date:2019-02-27
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (2.46 Å)
Cite:The structure of a prokaryotic viral envelope protein expands the landscape of membrane fusion proteins.
Nat Commun, 10, 2019
6QGL
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BU of 6qgl by Molmil
Crystal structure of VP5 from Haloarchaeal pleomorphic virus 6
Descriptor: BROMIDE ION, VP5
Authors:El Omari, K, Walter, T.S, Harlos, K, Grimes, J.M, Stuart, D.I, Roine, E.
Deposit date:2019-01-11
Release date:2019-02-27
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (2.69 Å)
Cite:The structure of a prokaryotic viral envelope protein expands the landscape of membrane fusion proteins.
Nat Commun, 10, 2019
8EUI
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BU of 8eui by Molmil
Ytm1 associated nascent 60S ribosome (-fkbp39) State 3
Descriptor: 60S ribosomal protein L10-A, 60S ribosomal protein L11-A, 60S ribosomal protein L13, ...
Authors:Zhou, X, Bilokapic, S, Deshmukh, A.A, Halic, M.
Deposit date:2022-10-18
Release date:2022-11-30
Last modified:2024-06-19
Method:ELECTRON MICROSCOPY (3.1 Å)
Cite:Chromatin localization of nucleophosmin organizes ribosome biogenesis.
Mol.Cell, 82, 2022
8ETI
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BU of 8eti by Molmil
Fkbp39 associated 60S nascent ribosome State 1
Descriptor: 60S ribosomal protein L13, 60S ribosomal protein L14, 60S ribosomal protein L15-A, ...
Authors:Zhou, X, Bilokapic, S, Deshmukh, A.A, Halic, M.
Deposit date:2022-10-17
Release date:2022-11-30
Last modified:2024-06-19
Method:ELECTRON MICROSCOPY (3.7 Å)
Cite:Chromatin localization of nucleophosmin organizes ribosome biogenesis.
Mol.Cell, 82, 2022
8ETH
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BU of 8eth by Molmil
Ytm1 associated 60S nascent ribosome State 1B
Descriptor: 60S ribosomal protein L13, 60S ribosomal protein L14, 60S ribosomal protein L15-A, ...
Authors:Zhou, X, Bilokapic, S, Deshmukh, A.A, Halic, M.
Deposit date:2022-10-17
Release date:2022-11-30
Last modified:2024-06-19
Method:ELECTRON MICROSCOPY (3.8 Å)
Cite:Chromatin localization of nucleophosmin organizes ribosome biogenesis.
Mol.Cell, 82, 2022
8ETG
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BU of 8etg by Molmil
Fkbp39 associated 60S nascent ribosome State 3
Descriptor: 60S ribosomal protein L13, 60S ribosomal protein L14, 60S ribosomal protein L15-A, ...
Authors:Zhou, X, Bilokapic, S, Deshmukh, A.A, Halic, M.
Deposit date:2022-10-17
Release date:2022-11-30
Last modified:2024-06-19
Method:ELECTRON MICROSCOPY (3.4 Å)
Cite:Chromatin localization of nucleophosmin organizes ribosome biogenesis.
Mol.Cell, 82, 2022
8ESR
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BU of 8esr by Molmil
Ytm1 associated nascent 60S ribosome (-fkbp39) State 2
Descriptor: 25S rRNA (cytosine-C(5))-methyltransferase nop2, 60S ribosomal protein L13, 60S ribosomal protein L14, ...
Authors:Zhou, X, Bilokapic, S, Deshmukh, A.A, Halic, M.
Deposit date:2022-10-14
Release date:2022-11-30
Last modified:2022-12-14
Method:ELECTRON MICROSCOPY (3.2 Å)
Cite:Chromatin localization of nucleophosmin organizes ribosome biogenesis.
Mol.Cell, 82, 2022
8EUP
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BU of 8eup by Molmil
Ytm1 associated 60S nascent ribosome State 1A
Descriptor: 60S ribosomal protein L13, 60S ribosomal protein L14, 60S ribosomal protein L15-A, ...
Authors:Zhou, X, Bilokapic, S, Deshmukh, A.A, Halic, M.
Deposit date:2022-10-19
Release date:2022-11-30
Last modified:2024-06-19
Method:ELECTRON MICROSCOPY (3.1 Å)
Cite:Chromatin localization of nucleophosmin organizes ribosome biogenesis.
Mol.Cell, 82, 2022
6QM2
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BU of 6qm2 by Molmil
NlaIV restriction endonuclease
Descriptor: POTASSIUM ION, SODIUM ION, Type-2 restriction enzyme NlaIV
Authors:Czapinska, H, Siwek, W, Szczepanowski, R.H, Bujnicki, J.M, Bochtler, M, Skowronek, K.
Deposit date:2019-02-01
Release date:2019-05-01
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Crystal Structure and Directed Evolution of Specificity of NlaIV Restriction Endonuclease.
J.Mol.Biol., 431, 2019
8EV3
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BU of 8ev3 by Molmil
Ytm1 associated 60S nascent ribosome (-Fkbp39) State 1B
Descriptor: 60S ribosomal protein L13, 60S ribosomal protein L14, 60S ribosomal protein L15-A, ...
Authors:Zhou, X, Bilokapic, S, Deshmukh, A.A, Halic, M.
Deposit date:2022-10-19
Release date:2022-11-30
Last modified:2024-06-19
Method:ELECTRON MICROSCOPY (3 Å)
Cite:Chromatin localization of nucleophosmin organizes ribosome biogenesis.
Mol.Cell, 82, 2022
8ETJ
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BU of 8etj by Molmil
Fkbp39 associated 60S nascent ribosome State 2
Descriptor: 60S ribosomal protein L13, 60S ribosomal protein L14, 60S ribosomal protein L15-A, ...
Authors:Zhou, X, Bilokapic, S, Deshmukh, A.A, Halic, M.
Deposit date:2022-10-17
Release date:2022-11-30
Last modified:2024-06-19
Method:ELECTRON MICROSCOPY (3.2 Å)
Cite:Chromatin localization of nucleophosmin organizes ribosome biogenesis.
Mol.Cell, 82, 2022
8EUG
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BU of 8eug by Molmil
Ytm1 associated nascent 60S ribosome State 3
Descriptor: 60S ribosomal protein L10-A, 60S ribosomal protein L11-A, 60S ribosomal protein L13, ...
Authors:Zhou, X, Bilokapic, S, Deshmukh, A.A, Halic, M.
Deposit date:2022-10-18
Release date:2022-11-30
Last modified:2024-06-19
Method:ELECTRON MICROSCOPY (2.8 Å)
Cite:Chromatin localization of nucleophosmin organizes ribosome biogenesis.
Mol.Cell, 82, 2022
8ETC
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BU of 8etc by Molmil
Fkbp39 associated nascent 60S ribosome State 4
Descriptor: 60S ribosomal protein L13, 60S ribosomal protein L14, 60S ribosomal protein L15-A, ...
Authors:Zhou, X, Bilokapic, S, Deshmukh, A.A, Halic, M.
Deposit date:2022-10-16
Release date:2022-11-30
Last modified:2024-06-19
Method:ELECTRON MICROSCOPY (3.1 Å)
Cite:Chromatin localization of nucleophosmin organizes ribosome biogenesis.
Mol.Cell, 82, 2022
8ESQ
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BU of 8esq by Molmil
Ytm1 associated nascent 60S ribosome State 2
Descriptor: 25S rRNA (cytosine-C(5))-methyltransferase nop2, 60S ribosomal protein L13, 60S ribosomal protein L14, ...
Authors:Zhou, X, Bilokapic, S, Deshmukh, A.A, Halic, M.
Deposit date:2022-10-14
Release date:2022-11-30
Last modified:2024-06-19
Method:ELECTRON MICROSCOPY (2.8 Å)
Cite:Chromatin localization of nucleophosmin organizes ribosome biogenesis.
Mol.Cell, 82, 2022
8EUY
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BU of 8euy by Molmil
Ytm1 associated nascent 60S ribosome (-fkbp39) State 1A
Descriptor: 60S ribosomal protein L13, 60S ribosomal protein L14, 60S ribosomal protein L15-A, ...
Authors:Zhou, X, Bilokapic, S, Deshmukh, A.A, Halic, M.
Deposit date:2022-10-19
Release date:2022-11-30
Last modified:2024-06-19
Method:ELECTRON MICROSCOPY (3 Å)
Cite:Chromatin localization of nucleophosmin organizes ribosome biogenesis.
Mol.Cell, 82, 2022
5IIS
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BU of 5iis by Molmil
Design, synthesis and structure activity relationship of potent pan-PIM kinase inhibitors derived from the pyridyl-amide scaffold
Descriptor: 3-amino-N-(2'-amino-6'-methyl[4,4'-bipyridin]-3-yl)-6-(2-fluorophenyl)pyridine-2-carboxamide, DI(HYDROXYETHYL)ETHER, Serine/threonine-protein kinase pim-1
Authors:Bellamacina, C, Bussiere, D, Burger, M.
Deposit date:2016-03-01
Release date:2016-04-06
Last modified:2016-05-04
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Design, synthesis and structure activity relationship of potent pan-PIM kinase inhibitors derived from the pyridyl carboxamide scaffold.
Bioorg.Med.Chem.Lett., 26, 2016
8G2M
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BU of 8g2m by Molmil
The tumor activated anti-CTLA-4 monoclonal antibody XTX101 demonstrates tumor-growth inhibition and tumor-selective pharmacodynamics in mouse models of cancer
Descriptor: CITRIC ACID, Heavy chain of humanized IgG, Light chain of humanized IgG, ...
Authors:Williams, J.C, Williams, J.C.
Deposit date:2023-02-05
Release date:2024-02-14
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:XTX101, a tumor-activated, Fc-enhanced anti-CTLA-4 monoclonal antibody, demonstrates tumor-growth inhibition and tumor-selective pharmacodynamics in mouse models of cancer.
J Immunother Cancer, 11, 2023
4R50
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BU of 4r50 by Molmil
Crystal Structure of CNG mimicking NaK-ETPP mutant cocrystallized with Li+
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, GLYCINE, Potassium channel protein
Authors:De March, M, Napolitano, L.M.R, Onesti, S.
Deposit date:2014-08-20
Release date:2015-07-01
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:A structural, functional, and computational analysis suggests pore flexibility as the base for the poor selectivity of CNG channels.
Proc.Natl.Acad.Sci.USA, 112, 2015
8G8N
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BU of 8g8n by Molmil
CTLA4 Fab with peptide
Descriptor: CYS-PRO-GLY-LYS-GLY-LEU-PRO-SER-CYS, Fab heavy chain, Fab light chain
Authors:Williams, J.C.
Deposit date:2023-02-18
Release date:2024-01-17
Method:X-RAY DIFFRACTION (3 Å)
Cite:XTX101, a tumor-activated, Fc-enhanced anti-CTLA-4 monoclonal antibody, demonstrates tumor-growth inhibition and tumor-selective pharmacodynamics in mouse models of cancer.
J Immunother Cancer, 11, 2023
8AJL
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BU of 8ajl by Molmil
Structure of the Ancestral Scaffold Antigen-6 of Coronavirus Spike protein
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Spike glycoprotein,Fibritin
Authors:Hueting, D, Schriever, K, Wallden, K, Andrell, J, Syren, P.O.
Deposit date:2022-07-28
Release date:2023-08-16
Last modified:2023-11-01
Method:ELECTRON MICROSCOPY (2.77 Å)
Cite:Design, structure and plasma binding of ancestral beta-CoV scaffold antigens.
Nat Commun, 14, 2023
8AJA
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BU of 8aja by Molmil
Structure of the Ancestral Scaffold Antigen-5 of Coronavirus Spike protein
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Spike glycoprotein,Fibritin
Authors:Hueting, D, Schriever, K, Wallden, K, Andrell, J, Syren, P.O.
Deposit date:2022-07-27
Release date:2023-08-16
Last modified:2023-11-01
Method:ELECTRON MICROSCOPY (2.59 Å)
Cite:Design, structure and plasma binding of ancestral beta-CoV scaffold antigens.
Nat Commun, 14, 2023

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