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3CIH
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BU of 3cih by Molmil
Crystal structure of a putative alpha-rhamnosidase from Bacteroides thetaiotaomicron
分子名称: 1,2-ETHANEDIOL, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Putative alpha-rhamnosidase
著者Kumaran, D, Burley, S.K, Swaminathan, S, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2008-03-11
公開日2008-04-01
最終更新日2021-02-03
実験手法X-RAY DIFFRACTION (2.33 Å)
主引用文献Crystal structure of a putative alpha-rhamnosidase from Bacteroides thetaiotaomicron.
To be Published
4CHE
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BU of 4che by Molmil
Crystal structure of the putative cap-binding domain of the PB2 subunit of Thogoto virus polymerase
分子名称: POLYMERASE BASIC PROTEIN 2
著者Guilligay, D, Kadlec, J, Crepin, T, Lunardi, T, Bouvier, D, Kochs, G, Ruigrok, R.W.H, Cusack, S.
登録日2013-12-01
公開日2014-02-05
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Comparative Structural and Functional Analysis of Orthomyxovirus Polymerase CAP-Snatching Domains.
Plos One, 9, 2014
2FGV
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BU of 2fgv by Molmil
X-ray crystal structure of HIV-1 Protease T80N variant in complex with the inhibitor saquinavir used to explore the role of invariant Thr80 in HIV-1 protease structure, function, and viral infectivity.
分子名称: (2S)-2-amino-3-phenylpropane-1,1-diol, 2-METHYL-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID, ASPARAGINE, ...
著者Foulkes, J.E, Prabu-Jeyabalan, M, Cooper, D, Schiffer, C.A.
登録日2005-12-22
公開日2006-11-07
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Role of invariant Thr80 in human immunodeficiency virus type 1 protease structure, function, and viral infectivity.
J.Virol., 80, 2006
2K8Y
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BU of 2k8y by Molmil
Solution NMR Structure of Cgi121 from Methanococcus jannaschii. Northeast Structural Genomics Consortium Target MJ0187
分子名称: Uncharacterized protein MJ0187
著者Rumpel, S, Fares, C, Neculai, D, Arrowsmith, C, Montelione, G.T, Sicheri, F, Northeast Structural Genomics Consortium (NESG)
登録日2008-09-25
公開日2008-11-04
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Atomic structure of the KEOPS complex: an ancient protein kinase-containing molecular machine.
Mol.Cell, 32, 2008
2FHC
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BU of 2fhc by Molmil
Crystal Structure Analysis of Klebsiella pneumoniae pullulanase complexed with maltotriose
分子名称: Alpha-dextrin endo-1,6-alpha-glucosidase, CALCIUM ION, alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose, ...
著者Mikami, B, Iwamoto, H, Katsuya, Y, Yoon, H.-J, Demirkan-Sarikaya, E, Malle, D.
登録日2005-12-23
公開日2006-06-13
最終更新日2022-03-09
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Crystal structure of pullulanase: evidence for parallel binding of oligosaccharides in the active site
J.Mol.Biol., 359, 2006
3CVA
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BU of 3cva by Molmil
Human Bcl-xL containing a Trp to Ala mutation at position 137
分子名称: Apoptosis regulator Bcl-X
著者Feng, Y, Zhang, L, Hu, T, Shen, X, Chen, K, Jiang, H, Liu, D.
登録日2008-04-18
公開日2009-03-24
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献A conserved hydrophobic core at Bcl-x(L) mediates its structural stability and binding affinity with BH3-domain peptide of pro-apoptotic protein
Arch.Biochem.Biophys., 484, 2009
4CSS
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BU of 4css by Molmil
Crystal structure of FimH in complex with a sulfonamide biphenyl alpha D-mannoside
分子名称: 4'-(alpha-D-Mannopyranosyloxy)-biphenyl-4-methyl sulfonamide, GLYCEROL, PROTEIN FIMH
著者Kleeb, S, Pang, L, Mayer, K, Sigl, A, Eris, D, Preston, R.C, Zihlmann, P, Abgottspon, D, Hutter, A, Scharenberg, M, Jian, X, Navarra, G, Rabbani, S, Smiesko, M, Luedin, N, Jakob, R.P, Schwardt, O, Maier, T, Sharpe, T, Ernst, B.
登録日2014-03-10
公開日2015-02-25
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.069 Å)
主引用文献Fimh Antagonists: Bioisosteres to Improve the in Vitro and in Vivo Pk/Pd Profile.
J.Med.Chem., 58, 2015
6CY7
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BU of 6cy7 by Molmil
Human Stimulator of Interferon Genes
分子名称: (2R,3R,3aS,5R,7aR,9R,10R,10aS,12R,14aR)-2,9-bis(6-amino-9H-purin-9-yl)octahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8 ]tetraoxadiphosphacyclododecine-3,5,10,12-tetrol 5,12-dioxide, GLYCEROL, IMIDAZOLE, ...
著者Fernandez, D, Li, L, Ergun, S.L.
登録日2018-04-04
公開日2019-03-13
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献STING Polymer Structure Reveals Mechanisms for Activation, Hyperactivation, and Inhibition.
Cell, 178, 2019
3CVZ
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BU of 3cvz by Molmil
Structural insights into the molecular organization of the S-layer from Clostridium difficile
分子名称: GLYCINE, PHOSPHATE ION, S-layer protein
著者Albesa-Jove, D, Fagan, R.
登録日2008-04-20
公開日2009-03-17
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structural insights into the molecular organization of the S-layer from Clostridium difficile
Mol.Microbiol., 71, 2009
3AAS
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BU of 3aas by Molmil
Bovine beta-trypsin bound to meta-guanidino schiff base copper (II) chelate
分子名称: (E)-N-[(5-carbamimidamido-2-hydroxyphenyl)methylidene]-L-alanine, CALCIUM ION, COPPER (II) ION, ...
著者Iyaguchi, D, Kawano, S, Toyota, E.
登録日2009-11-26
公開日2010-04-07
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Structural basis for the design of novel Schiff base metal chelate inhibitors of trypsin
Bioorg.Med.Chem., 18, 2010
3X1O
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BU of 3x1o by Molmil
Crystal structure of the ROQ domain of human Roquin
分子名称: IODIDE ION, Roquin-1
著者Ose, T, Verma, A, Cockburn, J.B, Berrow, N.S, Alderton, D, Stuart, D, Owens, R.J, Jones, E.Y.
登録日2014-11-26
公開日2015-03-11
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (2.201 Å)
主引用文献Roquin binds microRNA-146a and Argonaute2 to regulate microRNA homeostasis
Nat Commun, 6, 2015
3AEJ
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BU of 3aej by Molmil
Reaction intermediate structure of Entamoeba histolytica methionine gamma-lyase 1 tetramer containing Michaelis complex and methionine-pyridoxal-5'-phosphate
分子名称: GLYCEROL, METHIONINE, Methionine gamma-lyase, ...
著者Karaki, T, Sato, D, Shimizu, A, Nozaki, T, Harada, S.
登録日2010-02-10
公開日2011-02-09
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.59 Å)
主引用文献Crystal structure of Entamoeba histolytica methionine gamma-lyase 1
To be Published
6D1W
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BU of 6d1w by Molmil
human PKD2 F604P mutant
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Polycystin-2
著者Zheng, W, Yang, X, Bulkley, D, Chen, X.Z, Cao, E.
登録日2018-04-12
公開日2018-06-27
最終更新日2020-07-29
実験手法ELECTRON MICROSCOPY (3.54 Å)
主引用文献Hydrophobic pore gates regulate ion permeation in polycystic kidney disease 2 and 2L1 channels.
Nat Commun, 9, 2018
2EZ5
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BU of 2ez5 by Molmil
Solution Structure of the dNedd4 WW3* Domain- Comm LPSY Peptide Complex
分子名称: Commissureless LPSY Peptide, E3 ubiquitin-protein ligase NEDD4
著者Kanelis, V, Bruce, M.C, Skrynnikov, N.R, Rotin, D, Forman-Kay, J.D.
登録日2005-11-10
公開日2006-03-28
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Structural Determinants for High-Affinity Binding in a Nedd4 WW3(*) Domain-Comm PY Motif Complex
Structure, 14, 2006
4CGS
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BU of 4cgs by Molmil
Crystal structure of the N-terminal domain of the PA subunit of Dhori virus polymerase
分子名称: GLYCEROL, POLYMERASE SUBUNIT PA
著者Guilligay, D, Kadlec, J, Crepin, T, Lunardi, T, Bouvier, D, Kochs, G, Ruigrok, R.W.H, Cusack, S.
登録日2013-11-26
公開日2014-02-05
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献Comparative Structural and Functional Analysis of Orthomyxovirus Polymerase CAP-Snatching Domains.
Plos One, 9, 2014
2FH6
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BU of 2fh6 by Molmil
Crystal Structure Analysis of Klebsiella pneumoniae pullulanase complexed with glucose
分子名称: Alpha-dextrin endo-1,6-alpha-glucosidase, CALCIUM ION, alpha-D-glucopyranose
著者Mikami, B, Iwamoto, H, Katsuya, Y, Yoon, H.-J, Demirkan-Sarikaya, E, Malle, D.
登録日2005-12-23
公開日2006-06-13
最終更新日2022-03-09
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal structure of pullulanase: evidence for parallel binding of oligosaccharides in the active site
J.Mol.Biol., 359, 2006
2FIP
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BU of 2fip by Molmil
Phage phi29 transcription regulator p4
分子名称: Late genes activator
著者Badia, D, Camacho, A, Perez-Lago, L, Escandon, C, Salas, M, Coll, M.
登録日2005-12-30
公開日2006-09-26
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献The structure of phage phi29 transcription regulator p4-DNA complex reveals an N-hook motif for DNA
Mol.Cell, 22, 2006
2FCA
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BU of 2fca by Molmil
The structure of BsTrmB
分子名称: POTASSIUM ION, tRNA (guanine-N(7)-)-methyltransferase
著者Zegers, I, Van Vliet, F, Bujnicki, J, Kosinski, J, Gigot, D, Droogmans, L.
登録日2005-12-12
公開日2006-08-15
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Crystal structure of Bacillus subtilis TrmB, the tRNA (m7G46) methyltransferase.
Nucleic Acids Res., 34, 2006
2FCJ
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BU of 2fcj by Molmil
Structure of small TOPRIM domain protein from Bacillus stearothermophilus.
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, GLYCEROL, SULFATE ION, ...
著者Rezacova, P, Chen, Y, Borek, D, Collart, F, Joachimiak, A, Otwinowski, Z, Midwest Center for Structural Genomics (MCSG)
登録日2005-12-12
公開日2006-01-24
最終更新日2012-10-24
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献Crystal structure and putative function of small Toprim domain-containing protein from Bacillus stearothermophilus.
Proteins, 70, 2008
2FD9
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BU of 2fd9 by Molmil
X-ray Crystal Structure of Chemically Synthesized Crambin-{alpha}carboxamide
分子名称: Crambin
著者Bang, D, Tereshko, V, Kossiakoff, A.A, Kent, S.B.
登録日2005-12-13
公開日2007-01-16
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Role of a salt bridge in the model protein crambin explored by chemical protein synthesis: X-ray structure of a unique protein analogue, [V15A]crambin-alpha-carboxamide.
Mol Biosyst, 5, 2009
2FGU
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BU of 2fgu by Molmil
X-ray crystal structure of HIV-1 Protease T80S variant in complex with the inhibitor saquinavir used to explore the role of invariant Thr80 in HIV-1 protease structure, function, and viral infectivity.
分子名称: (2S)-2-amino-3-phenylpropane-1,1-diol, 2-METHYL-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID, ASPARAGINE, ...
著者Foulkes, J.E, Prabu-Jeyabalan, M, Cooper, D, Schiffer, C.A.
登録日2005-12-22
公開日2006-11-07
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Role of invariant Thr80 in human immunodeficiency virus type 1 protease structure, function, and viral infectivity.
J.Virol., 80, 2006
4IXR
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BU of 4ixr by Molmil
RT fs X-ray diffraction of Photosystem II, first illuminated state
分子名称: 1,2-DI-O-ACYL-3-O-[6-DEOXY-6-SULFO-ALPHA-D-GLUCOPYRANOSYL]-SN-GLYCEROL, 1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLE, 1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDE, ...
著者Kern, J, Alonso-Mori, R, Tran, R, Hattne, J, Gildea, R.J, Echols, N, Gloeckner, C, Hellmich, J, Laksmono, H, Sierra, R.G, Lassalle-Kaiser, B, Koroidov, S, Lampe, A, Han, G, Gul, S, DiFiore, D, Milathianaki, D, Fry, A.R, Miahnahri, A, Schafer, D.W, Messerschmidt, M, Seibert, M.M, Koglin, J.E, Sokaras, D, Weng, T.-C, Sellberg, J, Latimer, M.J, Grosse-Kunstleve, R.W, Zwart, P.H, White, W.E, Glatzel, P, Adams, P.D, Bogan, M.J, Williams, G.J, Boutet, S, Messinger, J, Zouni, A, Sauter, N.K, Yachandra, V.K, Bergmann, U, Yano, J.
登録日2013-01-27
公開日2013-02-20
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (5.9 Å)
主引用文献Simultaneous femtosecond X-ray spectroscopy and diffraction of photosystem II at room temperature.
Science, 340, 2013
5VOS
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BU of 5vos by Molmil
VGSNKGAIIGL from Amyloid Beta determined by MicroED
分子名称: Amyloid beta A4 protein
著者Rodriguez, J.A, Sawaya, M.R, Cascio, D, Eisenberg, D.S, Griner, S.L, Gonen, T.
登録日2017-05-03
公開日2018-01-03
最終更新日2024-03-13
実験手法ELECTRON CRYSTALLOGRAPHY (1.42 Å)
主引用文献Common fibrillar spines of amyloid-beta and human islet amyloid polypeptide revealed by microelectron diffraction and structure-based inhibitors.
J. Biol. Chem., 293, 2018
3AGQ
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BU of 3agq by Molmil
Structure of viral polymerase form II
分子名称: Elongation factor Ts, Elongation factor Tu 1, LINKER, ...
著者Takeshita, D, Tomita, K.
登録日2010-04-06
公開日2010-09-01
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (3.22 Å)
主引用文献Assembly of Q{beta} viral RNA polymerase with host translational elongation factors EF-Tu and -Ts
Proc.Natl.Acad.Sci.USA, 107, 2010
3AI8
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Cathepsin B in complex with the nitroxoline
分子名称: 5-nitroquinolin-8-ol, Cathepsin B
著者Renko, M, Mirkovic, B, Gobec, S, Kos, J, Turk, D.
登録日2010-05-11
公開日2011-05-18
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.11 Å)
主引用文献Novel mechanism of cathepsin B inhibition by antibiotic nitroxoline and related compounds
Chemmedchem, 6, 2011

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