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2NBO
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BU of 2nbo by Molmil
Solution structure of the F87M/L110M variant of transthyretin in the monomeric state
Descriptor: Transthyretin
Authors:Kim, J, Oroz, J, Zweckstetter, M.
Deposit date:2016-03-09
Release date:2017-02-22
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Mechanistic basis for the recognition of a misfolded protein by the molecular chaperone Hsp90.
Nat. Struct. Mol. Biol., 24, 2017
2NBP
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BU of 2nbp by Molmil
Solution structure of the T119M variant of transthyretin in its monomeric state
Descriptor: Transthyretin
Authors:Kim, J, Oroz, J, Zweckstetter, M.
Deposit date:2016-03-09
Release date:2017-05-10
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Structure of Monomeric Transthyretin Carrying the Clinically Important T119M Mutation.
Angew. Chem. Int. Ed. Engl., 55, 2016
7DXN
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BU of 7dxn by Molmil
Plant growth-promoting factor YxaL from Bacillus velezensis
Descriptor: CHLORIDE ION, Membrane associated protein kinase with beta-propeller domain, pyrrolo-quinoline quinone beta-propeller repeat
Authors:Baek, Y, Ha, N.-C.
Deposit date:2021-01-19
Release date:2022-01-19
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structure of the plant growth-promoting factor YxaL from the rhizobacterium Bacillus velezensis and its application to protein engineering.
Acta Crystallogr D Struct Biol, 78, 2022
2MXD
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BU of 2mxd by Molmil
Solution structure of VPg of porcine sapovirus
Descriptor: Viral protein genome-linked
Authors:Kim, J, Hwang, H, Min, H, Yun, H, Cho, K, Pelton, J.G, Wemmer, D.E, Lee, C.
Deposit date:2014-12-24
Release date:2015-04-15
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Solution structure of the porcine sapovirus VPg core reveals a stable three-helical bundle with a conserved surface patch.
Biochem.Biophys.Res.Commun., 459, 2015
5F8F
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BU of 5f8f by Molmil
Rv2258c-SFG
Descriptor: GLYCEROL, Methyltransferase, SINEFUNGIN
Authors:Im, H.N, Suh, S.W.
Deposit date:2015-12-09
Release date:2016-06-29
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal structure of Rv2258c from Mycobacterium tuberculosis H37Rv, an S-adenosyl-l-methionine-dependent methyltransferase
J.Struct.Biol., 193, 2016
3RUJ
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BU of 3ruj by Molmil
Crystal Structure of N-terminal region of yeast Atg7
Descriptor: Ubiquitin-like modifier-activating enzyme ATG7
Authors:Hong, S.B, Kim, B.W, Song, H.K.
Deposit date:2011-05-05
Release date:2011-11-23
Last modified:2013-07-03
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Insights into noncanonical E1 enzyme activation from the structure of autophagic E1 Atg7 with Atg8.
Nat.Struct.Mol.Biol., 18, 2011
4M84
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BU of 4m84 by Molmil
Calcium-Dependent Protein Kinase 1 from Toxoplasma gondii (TgCDPK1) in complex with inhibitor UW1455
Descriptor: 5-amino-1-tert-butyl-3-(quinolin-2-yl)-1H-pyrazole-4-carboxamide, Calmodulin-domain protein kinase 1
Authors:Merritt, E.A.
Deposit date:2013-08-12
Release date:2013-10-02
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.998 Å)
Cite:Potent and selective inhibitors of CDPK1 from T. gondii and C. parvum based on a 5-aminopyrazole-4-carboxamide scaffold.
ACS Med Chem Lett, 5, 2014
4LN5
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BU of 4ln5 by Molmil
Crystal structure of a trap periplasmic solute binding protein from burkholderia ambifaria (Bamb_6123), TARGET EFI-510059, with bound glycerol and chloride ion
Descriptor: CHLORIDE ION, GLYCEROL, TRAP dicarboxylate transporter, ...
Authors:Vetting, M.W, Toro, R, Bhosle, R, Al Obaidi, N.F, Morisco, L.L, Wasserman, S.R, Sojitra, S, Stead, M, Washington, E, Scott Glenn, A, Chowdhury, S, Evans, B, Hammonds, J, Hillerich, B, Love, J, Seidel, R.D, Imker, H.J, Gerlt, J.A, Almo, S.C, Enzyme Function Initiative (EFI)
Deposit date:2013-07-11
Release date:2013-08-14
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Experimental strategies for functional annotation and metabolism discovery: targeted screening of solute binding proteins and unbiased panning of metabolomes.
Biochemistry, 54, 2015
5XUY
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BU of 5xuy by Molmil
Crystal structure of ATG101-ATG13HORMA
Descriptor: Autophagy-related protein 101, Autophagy-related protein 13
Authors:Kim, B.-W, Song, H.K.
Deposit date:2017-06-26
Release date:2018-07-04
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:The C-terminal region of ATG101 bridges ULK1 and PtdIns3K complex in autophagy initiation.
Autophagy, 14, 2018
7S10
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BU of 7s10 by Molmil
Crystal Structure of ascorbate peroxidase triple mutant: S160M, L203M, Q204M
Descriptor: L-ascorbate peroxidase, POTASSIUM ION, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Poulos, T.L, Kim, J, Murarka, V.C.
Deposit date:2021-08-31
Release date:2022-09-07
Last modified:2024-09-11
Method:X-RAY DIFFRACTION (1.40000689 Å)
Cite:Computational analysis of the tryptophan cation radical energetics in peroxidase Compound I.
J.Biol.Inorg.Chem., 27, 2022
6IRK
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BU of 6irk by Molmil
Crystal structure of glucose isomerase by fixed-target serial femtosecond crystallography
Descriptor: MAGNESIUM ION, Xylose isomerase
Authors:Nam, K.H.
Deposit date:2018-11-13
Release date:2019-05-22
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Nylon mesh-based sample holder for fixed-target serial femtosecond crystallography.
Sci Rep, 9, 2019
6IG6
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BU of 6ig6 by Molmil
Crystal structure of lysozyme delivered in polyacrylamide using x-ray free electron laser
Descriptor: CHLORIDE ION, Lysozyme C, SODIUM ION
Authors:Nam, K.H.
Deposit date:2018-09-25
Release date:2018-11-07
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Polyacrylamide injection matrix for serial femtosecond crystallography.
Sci Rep, 9, 2019
4CRO
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BU of 4cro by Molmil
PROTEIN-DNA CONFORMATIONAL CHANGES IN THE CRYSTAL STRUCTURE OF A LAMBDA CRO-OPERATOR COMPLEX
Descriptor: DNA (5'-D(*TP*AP*TP*CP*AP*CP*CP*GP*CP*GP*GP*GP*TP*GP*AP*TP*A)-3'), PROTEIN (LAMBDA CRO)
Authors:Brennan, R.G, Roderick, S.L, Takeda, Y, Matthews, B.W.
Deposit date:1992-01-15
Release date:1992-01-15
Last modified:2022-11-23
Method:X-RAY DIFFRACTION (3.9 Å)
Cite:Protein-DNA conformational changes in the crystal structure of a lambda Cro-operator complex.
Proc.Natl.Acad.Sci.USA, 87, 1990
5SY1
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BU of 5sy1 by Molmil
Structure of the STRA6 receptor for retinol uptake in complex with calmodulin
Descriptor: CALCIUM ION, CHOLESTEROL, Calmodulin, ...
Authors:Clarke, O.B, Chen, Y, Mancia, F.
Deposit date:2016-08-10
Release date:2016-08-24
Last modified:2024-03-06
Method:ELECTRON MICROSCOPY (3.9 Å)
Cite:Structure of the STRA6 receptor for retinol uptake.
Science, 353, 2016
5WW0
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BU of 5ww0 by Molmil
Crystal structure of Set7, a novel histone methyltransferase in Schizossacharomyces pombe
Descriptor: SET domain-containing protein 7, SULFATE ION
Authors:Mevius, D.E.H.F, Shen, Y, Morishita, M, Carrozzini, B, Caliandro, R, di Luccio, E.
Deposit date:2016-12-30
Release date:2017-12-06
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Set7 Is a H3K37 Methyltransferase in Schizosaccharomyces pombe and Is Required for Proper Gametogenesis.
Structure, 27, 2019
2KRP
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BU of 2krp by Molmil
Solution structure of the E. coli tRNA-Arg2(acg) anticodon stem and loop
Descriptor: RNA (5'-R(*CP*UP*CP*GP*GP*CP*UP*AP*CP*GP*AP*AP*CP*CP*GP*AP*G)-3')
Authors:Bilbille, Y, Agris, P.F.
Deposit date:2009-12-22
Release date:2010-12-01
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Solution structure of the tRNA-Arg2 ASL containing the ACG anticodon
To be Published
2KRV
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BU of 2krv by Molmil
Solution structure of the E. coli tRNA-Arg1 (ICG) ASL containing the 2-thiocytidine modification
Descriptor: RNA (5'-R(*CP*UP*CP*GP*GP*(RSP)P*UP*IP*CP*GP*AP*AP*CP*CP*GP*AP*G)-3')
Authors:Bilbille, Y, Agris, P.F.
Deposit date:2009-12-22
Release date:2010-12-01
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Solution structure of the tRNA-Arg-1 (ICG) ASL containg the 2-thiocytidine modification in position 32.
To be Published
2KRQ
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BU of 2krq by Molmil
Solution structure of the tRNA-Arg2 (ICG) ASL.
Descriptor: RNA (5'-R(*CP*UP*CP*GP*GP*CP*UP*IP*CP*GP*AP*AP*CP*CP*GP*AP*G)-3')
Authors:Bilbille, Y, Agris, P.F.
Deposit date:2009-12-22
Release date:2010-12-01
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Solution structure of the tRNA-Arg2 (ICG) ASL
To be Published
2KRW
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BU of 2krw by Molmil
Solution structure of the E coli tRNA-Arg1 (ACG) containing the 2-thiocytidine modification in position 32
Descriptor: RNA (5'-R(*CP*UP*CP*GP*GP*(N)P*UP*AP*CP*GP*AP*AP*CP*CP*GP*AP*G)-3')
Authors:Bilbille, Y, Agris, P.F.
Deposit date:2009-12-22
Release date:2010-12-01
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Solution structure of the tRNA-Arg1 (ACG) containing the 2-thiocytidine modification in position 32
To be Published
5X6I
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BU of 5x6i by Molmil
Crystal structure of B. subtilis adenylate kinase variant
Descriptor: Adenylate kinase, BIS(ADENOSINE)-5'-PENTAPHOSPHATE, CALCIUM ION, ...
Authors:Moon, S, Bae, E.
Deposit date:2017-02-22
Release date:2018-02-28
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural and mutational analyses of psychrophilic and mesophilic adenylate kinases highlight the role of hydrophobic interactions in protein thermal stability.
Struct Dyn., 6, 2019
8D73
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BU of 8d73 by Molmil
Crystal Structure of EGFR LRTM with compound 7
Descriptor: (3S,4R)-3-fluoro-1-(4-{[4-(methylamino)-1-(propan-2-yl)pyrido[3,4-d]pyridazin-7-yl]amino}pyrimidin-2-yl)piperidin-4-ol, Epidermal growth factor receptor, GLYCEROL
Authors:Kim, J.L.
Deposit date:2022-06-07
Release date:2022-07-27
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.17 Å)
Cite:Discovery of BLU-945, a Reversible, Potent, and Wild-Type-Sparing Next-Generation EGFR Mutant Inhibitor for Treatment-Resistant Non-Small-Cell Lung Cancer.
J.Med.Chem., 65, 2022
8D76
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BU of 8d76 by Molmil
Crystal Structure of EGFR LRTM with compound 24
Descriptor: (3S,4R)-3-fluoro-1-(4-{[8-{3-[(methanesulfonyl)methyl]azetidin-1-yl}-5-(propan-2-yl)-2,7-naphthyridin-3-yl]amino}pyrimidin-2-yl)-3-methylpiperidin-4-ol, Epidermal growth factor receptor, GLYCEROL
Authors:Kim, J.L.
Deposit date:2022-06-07
Release date:2022-07-27
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Discovery of BLU-945, a Reversible, Potent, and Wild-Type-Sparing Next-Generation EGFR Mutant Inhibitor for Treatment-Resistant Non-Small-Cell Lung Cancer.
J.Med.Chem., 65, 2022
3SZB
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BU of 3szb by Molmil
Crystal structure of human ALDH3A1 modified with the beta-elimination product of Aldi-1; 1-phenyl- 2-propen-1-one
Descriptor: 1-phenylpropan-1-one, ACETATE ION, Aldehyde dehydrogenase, ...
Authors:Khanna, M, Hurley, T.D.
Deposit date:2011-07-18
Release date:2011-11-02
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.51 Å)
Cite:Discovery of a novel class of covalent inhibitor for aldehyde dehydrogenases.
J.Biol.Chem., 286, 2011
3SZA
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BU of 3sza by Molmil
Crystal structure of human ALDH3A1 - apo form
Descriptor: ACETATE ION, Aldehyde dehydrogenase, dimeric NADP-preferring, ...
Authors:Khanna, M, Hurley, T.D.
Deposit date:2011-07-18
Release date:2011-11-02
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.48 Å)
Cite:Discovery of a novel class of covalent inhibitor for aldehyde dehydrogenases.
J.Biol.Chem., 286, 2011
6PJW
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BU of 6pjw by Molmil
Adenylate kinase from Methanococcus igneus - AMP bound form
Descriptor: ADENOSINE MONOPHOSPHATE, Adenylate kinase, MAGNESIUM ION
Authors:Moon, S, Kim, J, Olmos, J.L, Bae, E, Phillips Jr, G.N.
Deposit date:2019-06-28
Release date:2020-01-22
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Adenylate kinase from Methanococcus igneus - AMP bound form
To Be Published

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