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5HH7
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BU of 5hh7 by Molmil
crystal structure of Arabidopsis ORC1b BAH-PHD cassette in complex with unmodified H3 peptide
分子名称: Histone H3 1-15 peptide, Origin of replication complex subunit 1B, ZINC ION
著者Li, S, Du, J.
登録日2016-01-10
公開日2016-03-09
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (1.901 Å)
主引用文献Structural Basis for the Unique Multivalent Readout of Unmodified H3 Tail by Arabidopsis ORC1b BAH-PHD Cassette
Structure, 24, 2016
6HW1
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BU of 6hw1 by Molmil
ROOM TEMPERATURE STRUCTURE OF LIPASE FROM T. LANUGINOSA AT 2.5 A RESOLUTION IN CHIPX MICROFLUIDIC DEVICE
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Lipase, MAGNESIUM ION, ...
著者Gavira, J.A, Fernadez-Penas, R, Martinez-Rodriguez, S, Verdugo-Escamilla, C.
登録日2018-10-11
公開日2018-10-24
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献A simple and versatile microfluidic device for efficient biomacromolecule crystallization and structural analysis by serial crystallography.
Iucrj, 6, 2019
5HE7
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BU of 5he7 by Molmil
BACE-1 in complex with (4aR,7aS)-7a-(2,4-difluorophenyl)-6-(5-fluoro-4-methoxy-6-methylpyrimidin-2-yl)-2-imino-3-methyloctahydro-4H-pyrrolo[3,4-d]pyrimidin-4-one
分子名称: (2E,4aR,7aS)-7a-(2,4-difluorophenyl)-6-(5-fluoro-4-methoxy-6-methylpyrimidin-2-yl)-2-imino-3-methyloctahydro-4H-pyrrolo[3,4-d]pyrimidin-4-one, Beta-secretase 1
著者Orth, P.
登録日2016-01-05
公開日2016-03-16
最終更新日2016-04-27
実験手法X-RAY DIFFRACTION (1.71 Å)
主引用文献Structure-Based Design of an Iminoheterocyclic beta-Site Amyloid Precursor Protein Cleaving Enzyme (BACE) Inhibitor that Lowers Central A beta in Nonhuman Primates.
J.Med.Chem., 59, 2016
4ZOZ
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BU of 4zoz by Molmil
Crystal structure of the Chaetomium thermophilum Sqt1 bound to the N-terminus of the ribosomal protein L10
分子名称: 60S ribosomal protein L10-like protein, Sqt1
著者Pausch, P, Altegoer, F, Bange, G.
登録日2015-05-07
公開日2015-07-01
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Co-translational capturing of nascent ribosomal proteins by their dedicated chaperones.
Nat Commun, 6, 2015
6TUD
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BU of 6tud by Molmil
Crystal structure of Y. pestis penicillin-binding protein 3
分子名称: Peptidoglycan D,D-transpeptidase FtsI
著者Pankov, G, Hunter, W.N, Dawson, A.
登録日2020-01-06
公開日2021-01-27
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献The structure of penicillin-binding protein 3 from Yersinia pestis
To Be Published
6TPH
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BU of 6tph by Molmil
Structure of a protein-RNA complex by ssNMR
分子名称: 50S ribosomal protein L7Ae, RNA (26-MER)
著者Mumdooh, A, Marchanka, A, Carlomagno, T.
登録日2019-12-13
公開日2020-02-12
最終更新日2024-06-19
実験手法SOLID-STATE NMR
主引用文献Structure of a Protein-RNA Complex by Solid-State NMR Spectroscopy.
Angew.Chem.Int.Ed.Engl., 59, 2020
5NMM
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BU of 5nmm by Molmil
The structure of the polo-box domain (PBD) of Plk1 in complex with Alpha-Bromo-3-Iodotoluene.
分子名称: Alpha-Bromo-3-Iodotoluene, Serine/threonine-protein kinase PLK1
著者Kunciw, D.L, Rossmann, M, Stokes, J.E, De Fusco, C, Spring, D.R, Hyvonen, M.
登録日2017-04-06
公開日2018-02-21
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.02 Å)
主引用文献A cryptic hydrophobic pocket in the polo-box domain of the polo-like kinase PLK1 regulates substrate recognition and mitotic chromosome segregation.
Sci Rep, 9, 2019
4ZQP
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BU of 4zqp by Molmil
Crystal Structure of the Catalytic Domain of the Inosine Monophosphate Dehydrogenase from Mycobacterium tuberculosis in the complex with IMP and the inhibitor MAD1
分子名称: 5'-O-({1-[(2E)-4-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-2-methylbut-2-en-1-yl]-1H-1,2,3-triazol-4-yl}methyl)adenosine, GLYCEROL, INOSINIC ACID, ...
著者Kim, Y, Makowska-Grzyska, M, Gu, M, Kavitha, M, Hedstrom, L, Anderson, W.F, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID)
登録日2015-05-10
公開日2015-06-17
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Mycobacterium tuberculosis IMPDH in Complexes with Substrates, Products and Antitubercular Compounds.
Plos One, 10, 2015
6J2W
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BU of 6j2w by Molmil
The structure of OBA3-OTA complex
分子名称: DNA (5'-D(*CP*GP*GP*GP*GP*CP*GP*AP*AP*GP*CP*GP*GP*GP*TP*CP*CP*CP*G)-3'), N-[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carbonyl]-D-phenylalanine
著者Xu, G.H, Li, C.G.
登録日2019-01-03
公開日2019-02-27
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Structure-guided post-SELEX optimization of an ochratoxin A aptamer.
Nucleic Acids Res., 47, 2019
6J9P
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BU of 6j9p by Molmil
Solution structure of a salt-resistant antimicrobial peptide, RR12
分子名称: salt-resistant antimicrobial peptide RR12
著者Tseng, T.S.
登録日2019-01-24
公開日2020-01-29
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Solution structure of a salt-resistant antimicrobial peptide, RR12
To Be Published
4ZKJ
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BU of 4zkj by Molmil
Crystal structure of CRISPR-associated protein
分子名称: CRISPR-associated protein Cas1, GLYCEROL
著者Ka, D, Bae, E.
登録日2015-04-30
公開日2016-01-13
最終更新日2016-01-20
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Crystal Structure of Streptococcus pyogenes Cas1 and Its Interaction with Csn2 in the Type II CRISPR-Cas System
Structure, 24, 2016
5N93
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BU of 5n93 by Molmil
TTK kinase domain in complex with TC-Mps1-12
分子名称: 4-[[4-azanyl-6-(~{tert}-butylamino)-5-cyano-pyridin-2-yl]amino]benzamide, Dual specificity protein kinase TTK
著者Uitdehaag, J, Willemsen-Seegers, N, de Man, J, Buijsman, R.C, Zaman, G.J.R.
登録日2017-02-24
公開日2017-05-31
最終更新日2017-08-23
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Target Residence Time-Guided Optimization on TTK Kinase Results in Inhibitors with Potent Anti-Proliferative Activity.
J. Mol. Biol., 429, 2017
6JSX
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BU of 6jsx by Molmil
Structure of a flagellin protein, HpFlaG
分子名称: Flagellar biosynthesis protein FlaG
著者Tsai, J.Y, Sun, Y.J, Hsiao, C.D.
登録日2019-04-08
公開日2020-04-08
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Crystal structure of the flagellin protein FlaG from Helicobacter pylori.
J Chin Chem Soc, 66, 2019
5EO0
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BU of 5eo0 by Molmil
Crystal Structure of HLA-B0702-RFL9
分子名称: Beta-2-microglobulin, HLA class I histocompatibility antigen, B-7 alpha chain, ...
著者Josephs, T.M, Gras, S, Rossjohn, J.
登録日2015-11-10
公開日2016-02-24
最終更新日2016-04-20
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献HIV-1-Specific CD8 T Cells Exhibit Limited Cross-Reactivity during Acute Infection.
J Immunol., 196, 2016
4ZN0
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BU of 4zn0 by Molmil
Structure of the NADPH-dependent thioredoxin reductase from Methanosarcina mazei
分子名称: Thioredoxin reductase
著者Buey, R.M, de Pereda, J.M, Balsera, M.
登録日2015-05-04
公開日2016-06-29
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Crystal Structure of the Apo-Form of NADPH-Dependent Thioredoxin Reductase from a Methane-Producing Archaeon.
Antioxidants (Basel), 7, 2018
4ZK3
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BU of 4zk3 by Molmil
Psoriasis pathogenesis - Pso p27 constitute a compact structure forming large aggregates. Low pH structure
分子名称: Serpin B3
著者Helland, R, Lysvand, H, Slupphaug, G, Iversen, O.J.
登録日2015-04-29
公開日2015-07-01
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Psoriasis pathogenesis - Pso p27 constitutes a compact structure forming large aggregates.
Biochem Biophys Rep, 2, 2015
7B3Z
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BU of 7b3z by Molmil
Crystal structure of c-MET bound by compound 5
分子名称: 3-[3-(phenylmethyl)-1~{H}-pyrrolo[2,3-b]pyridin-5-yl]-4,5-dihydro-1~{H}-pyrrolo[3,4-b]pyrrol-6-one, DIMETHYL SULFOXIDE, Hepatocyte growth factor receptor
著者Collie, G.W.
登録日2020-12-01
公開日2020-12-09
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structural Basis for Targeting the Folded P-Loop Conformation of c-MET.
Acs Med.Chem.Lett., 12, 2021
4ZOM
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BU of 4zom by Molmil
RORgamma in complex with inverse agonist 4j.
分子名称: N-{4-[3-(acetylamino)-1-(propan-2-yl)-1H-pyrazol-5-yl]-2-[(1R,5S)-3-azabicyclo[3.1.0]hex-3-yl]phenyl}-2-chloro-6-fluoro-N-methylbenzamide, Nuclear receptor ROR-gamma
著者Marcotte, D.J.
登録日2015-05-06
公開日2015-06-17
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.27 Å)
主引用文献Discovery of novel pyrazole-containing benzamides as potent ROR gamma inverse agonists.
Bioorg.Med.Chem.Lett., 25, 2015
5EKB
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BU of 5ekb by Molmil
R2-like ligand-binding oxidase with aerobically reconstituted Mn/Fe cofactor (reconstituted in solution)
分子名称: FE (III) ION, MANGANESE (III) ION, PALMITIC ACID, ...
著者Griese, J.J, Hogbom, M.
登録日2015-11-03
公開日2016-04-27
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.074 Å)
主引用文献Divergent assembly mechanisms of the manganese/iron cofactors in R2lox and R2c proteins.
J.Inorg.Biochem., 162, 2016
7BDW
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BU of 7bdw by Molmil
Crystal structure of mycobacterial PptAb in complex with ACP and compound 8918
分子名称: COENZYME A, MANGANESE (II) ION, N-(2,6-diethylphenyl)-N'-(N-ethylcarbamimidoyl)urea, ...
著者Carivenc, C, Nguyen, M.C, Mourey, L, Pedelacq, J.D.
登録日2020-12-22
公開日2021-11-10
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.55 Å)
主引用文献Phosphopantetheinyl transferase binding and inhibition by amidino-urea and hydroxypyrimidinethione compounds.
Sci Rep, 11, 2021
6K1M
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BU of 6k1m by Molmil
Engineered form of a putative cystathionine gamma-lyase
分子名称: Cystathionine gamma-lyase, PYRIDOXAL-5'-PHOSPHATE, PYRUVIC ACID
著者Chen, S, Wang, Y.
登録日2019-05-10
公開日2020-05-13
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.32 Å)
主引用文献Structural characterization of cystathionine gamma-lyase smCSE enables aqueous metal quantum dot biosynthesis.
Int.J.Biol.Macromol., 174, 2021
5EOJ
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BU of 5eoj by Molmil
Crystal structure of an antiparallel hexamer coiled-coil - ACC-Hex-PheI
分子名称: ACC-Hex-PheI
著者Spencer, R.K, Hochbaum, A.I.
登録日2015-11-10
公開日2016-05-25
最終更新日2022-12-14
実験手法X-RAY DIFFRACTION (2.115 Å)
主引用文献X-ray Crystallographic Structure and Solution Behavior of an Antiparallel Coiled-Coil Hexamer Formed by de Novo Peptides.
Biochemistry, 55, 2016
5EON
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BU of 5eon by Molmil
Crystal structure of a de novo antiparallel coiled-coil hexamer - ACC-Hex
分子名称: ACC-Hex
著者Spencer, R.K, Hochbaum, A.I.
登録日2015-11-10
公開日2016-05-25
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.696 Å)
主引用文献X-ray Crystallographic Structure and Solution Behavior of an Antiparallel Coiled-Coil Hexamer Formed by de Novo Peptides.
Biochemistry, 55, 2016
7BHE
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BU of 7bhe by Molmil
DARPin_D5/Her3 domain 4 complex, monoclinic crystals
分子名称: ACETATE ION, DARPin_D5, GLYCEROL, ...
著者Mittl, P.R.E, Radom, F, Pluckthun, A.
登録日2021-01-11
公開日2021-11-24
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.297 Å)
主引用文献Crystal structures of HER3 extracellular domain 4 in complex with the designed ankyrin-repeat protein D5.
Acta Crystallogr.,Sect.F, 77, 2021
5EOS
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Crystallizing Strained DNA: Self-Assembly of 3D Crystals Containing a Torsionally-Stressed Component
分子名称: DNA (5'-D(*TP*CP*TP*GP*AP*TP*GP*TP*GP*CP*TP*GP*C)-3'), DNA (5'-D(P*AP*CP*GP*GP*AP*CP*AP*TP*CP*A)-3'), DNA (5'-D(P*CP*AP*CP*AP*CP*CP*GP*T)-3'), ...
著者Hernandez, C, Birktoft, J.J, Seeman, N.C.
登録日2015-11-10
公開日2017-08-09
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (4.7 Å)
主引用文献Self-Assembly of 3D DNA Crystals Containing a Torsionally Stressed Component.
Cell Chem Biol, 2017

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