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4M4V
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Structural evaluation R171L mutant of the aspergillus fumigatus kdnase (sialidase)
分子名称: 2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID, Extracellular sialidase/neuraminidase, putative, ...
著者Telford, J.C, Taylor, G.L.
登録日2013-08-07
公開日2014-09-17
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.84 Å)
主引用文献Active site mutants of a fungal KDNase
To be Published
4M7F
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Crystal structure of tetrameric fibrinogen-like recognition domain of FIBCD1 with bound ManNAc
分子名称: 2-acetamido-2-deoxy-alpha-D-mannopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, ...
著者Shrive, A.K, Greenhough, T.J, Holmskov, U.
登録日2013-08-12
公開日2013-12-11
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Crystal Structure of the Tetrameric Fibrinogen-like Recognition Domain of Fibrinogen C Domain Containing 1 (FIBCD1) Protein.
J.Biol.Chem., 289, 2014
4M9P
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Crystal structure of the human filamin A Ig-like domains 3-5
分子名称: Filamin-A
著者Seppala, J, Pentikainen, U, Ylanne, J.
登録日2013-08-15
公開日2014-02-05
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.72 Å)
主引用文献A Novel Structural Unit in the N-terminal Region of Filamins.
J.Biol.Chem., 289, 2014
4M6H
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Structure of the reduced, metal-free form of Mycobacterium tuberculosis peptidoglycan amidase Rv3717
分子名称: Peptidoglycan Amidase Rv3717
著者Prigozhin, D.M, Mavrici, D, Huizar, J.P, Vansell, H.J, Alber, T, TB Structural Genomics Consortium (TBSGC)
登録日2013-08-09
公開日2013-09-18
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.194 Å)
主引用文献Structural and Biochemical Analyses of Mycobacterium tuberculosis N-Acetylmuramyl-L-alanine Amidase Rv3717 Point to a Role in Peptidoglycan Fragment Recycling.
J.Biol.Chem., 288, 2013
4M76
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Integrin I domain of complement receptor 3 in complex with C3d
分子名称: Complement C3, Integrin alpha-M, NICKEL (II) ION
著者Bajic, G, Yatime, L, Vorup-Jensen, T, Andersen, G.R.
登録日2013-08-12
公開日2013-10-02
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.804 Å)
主引用文献Structural insight on the recognition of surface-bound opsonins by the integrin I domain of complement receptor 3.
Proc.Natl.Acad.Sci.USA, 110, 2013
4MEQ
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Crystal Structure of the first bromodomain of human BRD4 in complex with a 5-methyl-triazolopyrimidine ligand
分子名称: 1,2-ETHANEDIOL, 5-methyl-7-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-2-amine, Bromodomain-containing protein 4
著者Filippakopoulos, P, Picaud, S, Felletar, I, Martin, S, Fedorov, O, Vidler, L.R, Brown, N, von Delft, F, Arrowsmith, C.H, Edwards, A.M, Weigelt, J, Bountra, C, Hoelder, S, Knapp, S, Structural Genomics Consortium (SGC)
登録日2013-08-27
公開日2013-09-25
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.77 Å)
主引用文献Discovery of Novel Small-Molecule Inhibitors of BRD4 Using Structure-Based Virtual Screening.
J.Med.Chem., 56, 2013
4M97
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Calcium-Dependent Protein Kinase 1 from Neospora caninum
分子名称: Calmodulin-like domain protein kinase isoenzyme gamma, related
著者Merritt, E.A.
登録日2013-08-14
公開日2013-10-02
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Neospora caninum Calcium-Dependent Protein Kinase 1 Is an Effective Drug Target for Neosporosis Therapy.
Plos One, 9, 2014
4MAI
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Structure of Aspergillus oryzae AA11 Lytic Polysaccharide Monooxygenase with Cu(I)
分子名称: 1,2-ETHANEDIOL, AA11 Lytic Polysaccharide Monooxygenase, CHLORIDE ION, ...
著者Hemsworth, G.R, Henrissat, B, Walton, P.H, Davies, G.J.
登録日2013-08-16
公開日2013-12-18
最終更新日2017-11-15
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Discovery and characterization of a new family of lytic polysaccharide monooxygenases.
Nat.Chem.Biol., 10, 2014
4MAR
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Crystal structure of purine nucleoside phosphorylase from Meiothermus ruber DSM 1279 complexed with sulfate.
分子名称: MAGNESIUM ION, Purine nucleoside phosphorylase DeoD-type, SULFATE ION
著者Malashkevich, V.N, Bhosle, R, Toro, R, Hillerich, B, Gizzi, A, Garforth, S, Kar, A, Chan, M.K, Lafluer, J, Patel, H, Matikainen, B, Chamala, S, Lim, S, Celikgil, A, Villegas, G, Evans, B, Love, J, Fiser, A, Khafizov, K, Seidel, R, Bonanno, J.B, Almo, S.C, New York Structural Genomics Research Consortium (NYSGRC)
登録日2013-08-16
公開日2013-10-09
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (2.16 Å)
主引用文献Crystal structure of purine nucleoside phosphorylase from Meiothermus ruber DSM 1279 complexed with sulfate.
To be Published
4MDG
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Closo Carborane Carbonic Anhydrase Inhibitor
分子名称: 1-(sulfamoylamino)methyl-1,2-dicarba-closo-dodecaborane, Carbonic anhydrase 2, ZINC ION
著者Brynda, J, Mader, P, Rezacova, P.
登録日2013-08-22
公開日2014-01-01
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献Carborane-based carbonic anhydrase inhibitors.
Angew.Chem.Int.Ed.Engl., 52, 2013
4LP5
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Crystal structure of the full-length human RAGE extracellular domain (VC1C2 fragment)
分子名称: Advanced glycosylation end product-specific receptor
著者Yatime, L, Andersen, G.R.
登録日2013-07-15
公開日2013-10-16
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (3.8 Å)
主引用文献Structural insights into the oligomerization mode of the human receptor for advanced glycation end-products.
Febs J., 280, 2013
4LSR
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BU of 4lsr by Molmil
Crystal structure of broadly and potently neutralizing antibody VRC-CH31 in complex with HIV-1 clade A/E stran 93TH057 gp120 with LOOP D and Loop V5 from clade A strain KER_2018_11
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, ENVELOPE GLYCOPROTEIN GP120 WITH LOOP D AND V5 FROM STRAIN ker_2018_11, HEAVY CHAIN OF ANTIBODY VRC-CH31, ...
著者Zhou, T, Moquin, S, Kwong, P.D.
登録日2013-07-23
公開日2013-08-21
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (2.28 Å)
主引用文献Multidonor Analysis Reveals Structural Elements, Genetic Determinants, and Maturation Pathway for HIV-1 Neutralization by VRC01-Class Antibodies.
Immunity, 39, 2013
4KZK
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The structure of the periplasmic L-arabinose binding protein from Burkholderia thailandensis
分子名称: L-arabinose ABC transporter, periplasmic L-arabinose-binding protein, beta-D-galactopyranose
著者Seattle Structural Genomics Center for Infectious Disease (SSGCID)
登録日2013-05-30
公開日2013-06-26
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献The structure of the periplasmic L-arabinose binding protein from Burkholderia thailandensis
TO BE PUBLISHED
4DY6
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Crystal structure of NAD kinase 1 from Listeria monocytogenes in complex with 2'-phosphate bis(adenosine)-5'-diphosphate
分子名称: CITRIC ACID, [(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL]METHYL [(2R,3R,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3-HYDROXY-4-(PHOSPHONOOXY)TETRAHYDROFURAN-2-YL]METHYL DIHYDROGEN DIPHOSPHATE, inorganic polyphosphate/ATP-NAD kinase 1
著者Poncet-Montange, G, Assairi, L, Arold, S, Pochet, S, Labesse, G.
登録日2012-02-28
公開日2012-03-07
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献NAD kinases use substrate-assisted catalysis for specific recognition of NAD.
J.Biol.Chem., 282, 2007
4L5F
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Crystal Structure of DENV1-E106 Fab bound to DENV-1 Envelope protein DIII
分子名称: Envelope protein, Heavy chain of E106 antibody (VH and CH1 of IgG2c), Light chain of E106 antibody (kappa)
著者Edeling, M.A, Nelson, C.A, Fremont, D.H, Center for Structural Genomics of Infectious Diseases (CSGID)
登録日2013-06-11
公開日2013-12-11
最終更新日2017-11-15
実験手法X-RAY DIFFRACTION (2.45 Å)
主引用文献Crystal Structure of DENV1-E106 Fab bound to DENV-1 Envelope protein DIII
To be Published
4L5O
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Crystal structure of 26 kDa GST D26H mutant of Clonorchis sinensis
分子名称: GLUTATHIONE, Putative glutathione transferase, SULFATE ION, ...
著者Chung, Y.J, Han, Y.H.
登録日2013-06-11
公開日2013-09-11
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (2.09 Å)
主引用文献Crystal structures of 26kDa Clonorchis sinensis glutathione S-transferase reveal zinc binding and putative metal binding.
Biochem.Biophys.Res.Commun., 438, 2013
4E05
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Anophelin from the malaria vector inhibits thrombin through a novel reverse-binding mechanism
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, SODIUM ION, Salivary anti-thrombin peptide anophelin, ...
著者Figueiredo, A.C, de Sanctis, D, Gutierrez-Gallego, R, Cereija, T.B, Macedo-Ribeiro, S, Fuentes-Prior, P, Pereira, P.J.B.
登録日2012-03-02
公開日2012-12-05
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.304 Å)
主引用文献Unique thrombin inhibition mechanism by anophelin, an anticoagulant from the malaria vector.
Proc.Natl.Acad.Sci.USA, 109, 2012
4E1I
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Fragment of human prion protein
分子名称: Major prion protein
著者Apostol, M.I, Surewicz, W.K.
登録日2012-03-06
公開日2013-03-06
最終更新日2013-11-27
実験手法X-RAY DIFFRACTION (2.03 Å)
主引用文献Crystal structure of a human prion protein fragment reveals a motif for oligomer formation.
J.Am.Chem.Soc., 135, 2013
4LBN
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Crystal structure of Human galectin-3 CRD in complex with LNnT
分子名称: CHLORIDE ION, Galectin-3, beta-D-galactopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-3)-beta-D-galactopyranose-(1-4)-alpha-D-glucopyranose
著者Collins, P.M, Blanchard, H.
登録日2013-06-20
公開日2014-01-22
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Galectin-3 interactions with glycosphingolipids.
J.Mol.Biol., 426, 2014
4LBZ
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Identifying ligand binding hot spots in proteins using brominated fragments
分子名称: AMMONIUM ION, Elongation factor Tu-A, MAGNESIUM ION, ...
著者Groftehauge, M.K, Therkelsen, M, Taaning, R, Skrydstrup, T, Morth, J.P, Nissen, P.
登録日2013-06-21
公開日2013-09-11
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.223 Å)
主引用文献Identifying ligand-binding hot spots in proteins using brominated fragments.
Acta Crystallogr.,Sect.F, 69, 2013
4LCC
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Crystal structure of a human MAIT TCR in complex with a bacterial antigen bound to humanized bovine MR1
分子名称: 1-deoxy-1-[6-(hydroxymethyl)-2,4-dioxo-3,4-dihydropteridin-8(2H)-yl]-D-arabinitol, Beta-2-microglobulin, MHC class I-related protein, ...
著者Lopez-Sagaseta, J, Adams, E.J.
登録日2013-06-21
公開日2013-10-16
最終更新日2018-01-24
実験手法X-RAY DIFFRACTION (3.263 Å)
主引用文献MAIT Recognition of a Stimulatory Bacterial Antigen Bound to MR1.
J.Immunol., 191, 2013
4L7S
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Kinase domain mutant of human Itk in complex with an aminobenzothiazole inhibitor
分子名称: SULFATE ION, Tyrosine-protein kinase ITK/TSK, trans-4-({4-[difluoro(4-fluorophenyl)methyl]-6-[(5-methoxy[1,3]thiazolo[5,4-b]pyridin-2-yl)amino]pyrimidin-2-yl}amino)cyclohexanol
著者Somers, D.O.
登録日2013-06-14
公開日2014-01-22
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.03 Å)
主引用文献Identification of a Novel and Selective Series of Itk Inhibitors via a Template-Hopping Strategy.
ACS Med Chem Lett, 4, 2013
4L8B
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Crystal structure of the H2Db in complex with the NP-N5H peptide
分子名称: Beta-2-microglobulin, DI(HYDROXYETHYL)ETHER, H-2 class I histocompatibility antigen, ...
著者Rossjohn, J, Gras, S.
登録日2013-06-16
公開日2013-10-16
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Acute emergence and reversion of influenza A virus quasispecies within CD8(+) T cell antigenic peptides.
Nat Commun, 4, 2013
4E1T
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X-ray crystal structure of the transmembrane beta-domain from invasin from Yersinia pseudotuberculosis
分子名称: (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, (2S)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, Invasin
著者Fairman, J.W, Dautin, N, Wojtowicz, D, Wei, L, Noinaj, N, Barnard, T.J, Udho, E, Finkelstein, A, Przytycka, T.M, Cherezov, V, Buchanan, S.K.
登録日2012-03-07
公開日2012-06-13
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.263 Å)
主引用文献Crystal Structures of the Outer Membrane Domain of Intimin and Invasin from Enterohemorrhagic E. coli and Enteropathogenic Y. pseudotuberculosis.
Structure, 20, 2012
4DZV
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Complex of 4-alpha/beta bound to gp41-5
分子名称: 4-alpha/beta, GLYCEROL, gp41-5
著者Johnson, L.M, Mortenson, D.E, Yun, H.G, Horne, W.S, Ketas, T.J, Lu, M, Moore, J.P, Gellman, S.H.
登録日2012-03-01
公開日2012-05-02
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Enhancement of alpha-helix mimicry by an alpha / beta-peptide foldamer via incorporation of a dense ionic side-chain array.
J.Am.Chem.Soc., 134, 2012

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