PDB: 66507 resultsInfo pagesStatus searchChemie searchBIRD

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4FJ2	Crystal structure of the ternary complex between a fungal 17beta-hydroxysteroid dehydrogenase (Holo form) and biochanin A Descriptor: 1,2-ETHANEDIOL, 17beta-hydroxysteroid dehydrogenase, 5,7-dihydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one, ... Authors: Cassetta, A, Lamba, D, Krastanova, I. Deposit date: 2012-06-11 Release date: 2013-07-03 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Structural basis for inhibition of 17 beta-hydroxysteroid dehydrogenases by phytoestrogens: The case of fungal 17 beta-HSDcl. J. Steroid Biochem. Mol. Biol., 171, 2017
1J2G	Crystal structure of Urate oxidase from Bacillus SP. TB-90 co-crystallized with 8-Azaxanthine Descriptor: 8-AZAXANTHINE, SULFATE ION, Uricase Authors: Hibi, T, Nago, T, Nishiya, Y, Oda, J. Deposit date: 2003-01-05 Release date: 2004-06-15 Last modified: 2023-12-27 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Crystal structure of urate oxidase from Bacillus SP. To be Published
3UDR	Crystal Structure of BACE with Compound 14 Descriptor: 1,2-ETHANEDIOL, 1-cyanocyclohexyl (3S,5'R)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-5'-carboxylate, Beta-secretase 1, ... Authors: Efremov, I.V, Vajdos, F.F, Borzilleri, K, Capetta, S, Dorff, P, Dutra, J, Mansour, M, Oborski, C, O'Connell, T, O'Sullivan, T.J, Pandit, J, Wang, H, Withka, J. Deposit date: 2011-10-28 Release date: 2012-04-18 Last modified: 2018-04-04 Method: X-RAY DIFFRACTION (1.95 Å) Cite: Discovery and optimization of a novel spiropyrrolidine inhibitor of {beta}-secretase (BACE1) through fragment-based drug design. J.Med.Chem., 55, 2012
4FJN	RB69 DNA polymerase ternary complex with dTTP/dA Descriptor: CALCIUM ION, DNA polymerase, DNA primer, ... Authors: Xia, S, Wang, J, Konigsberg, W.H. Deposit date: 2012-06-11 Release date: 2012-12-19 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.98 Å) Cite: DNA mismatch synthesis complexes provide insights into base selectivity of a B family DNA polymerase. J.Am.Chem.Soc., 135, 2013
3V47	Crystal structure of the N-terminal fragment of zebrafish TLR5 in complex with Salmonella flagellin Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Flagellin, ... Authors: Yoon, S.I, Hong, H, Wilson, I.A. Deposit date: 2011-12-14 Release date: 2012-02-29 Last modified: 2020-07-29 Method: X-RAY DIFFRACTION (2.47 Å) Cite: Structural basis of TLR5-flagellin recognition and signaling. Science, 335, 2012
6XCZ	Porcine pepsin in complex with saquinavir Descriptor: (2S)-N-[(2S,3R)-4-[(2S,3S,4aS,8aS)-3-(tert-butylcarbamoyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-3-hydroxy-1 -phenyl-butan-2-yl]-2-(quinolin-2-ylcarbonylamino)butanediamide, Pepsin A Authors: Vuksanovic, N, Silvaggi, N.R. Deposit date: 2020-06-09 Release date: 2021-06-16 Last modified: 2023-10-18 Method: X-RAY DIFFRACTION (1.89 Å) Cite: Porcine pepsin in complex with saquinavir To Be Published
4FGI	Structure of the effector - immunity system Tse1 / Tsi1 from Pseudomonas aeruginosa Descriptor: Tse1, Tsi1 Authors: Benz, J, Sendlmeier, C, Barends, T.R.M, Meinhart, A. Deposit date: 2012-06-04 Release date: 2012-06-20 Last modified: 2012-07-25 Method: X-RAY DIFFRACTION (3.2 Å) Cite: Structural Insights into the Effector - Immunity System Tse1/Tsi1 from Pseudomonas aeruginosa. Plos One, 7, 2012
4FHF	Spore photoproduct lyase C140A mutant with dinucleoside spore photoproduct Descriptor: 1-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-5-[[(5R)-1-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-5-methyl-2,4-bis(oxidanylidene)-1,3-diazinan-5-yl]methyl]pyrimidine-2,4-dione, IRON/SULFUR CLUSTER, PYROPHOSPHATE 2-, ... Authors: Benjdia, A, Heil, K, Barends, T.R.M, Carell, T, Schlichting, I. Deposit date: 2012-06-06 Release date: 2012-07-18 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Structural insights into recognition and repair of UV-DNA damage by Spore Photoproduct Lyase, a radical SAM enzyme. Nucleic Acids Res., 40, 2012
4FKJ	Crystal structure of the cdk2 in complex with aminopyrazole inhibitor Descriptor: ACETATE ION, Cyclin-dependent kinase 2, N-(3-cyclopropyl-1H-pyrazol-5-yl)-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide Authors: Kang, Y.N, Stuckey, J.A. Deposit date: 2012-06-13 Release date: 2013-05-08 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.63 Å) Cite: Crystal structure of the cdk2 in complex with aminopyrazole inhibitor To be Published
3V5W	Human G Protein-Coupled Receptor Kinase 2 in Complex with Soluble Gbetagamma Subunits and Paroxetine Descriptor: G-protein coupled receptor kinase 2, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1, ... Authors: Thal, D.M, Tesmer, J.J.G. Deposit date: 2011-12-17 Release date: 2012-09-26 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2.07 Å) Cite: Paroxetine is a direct inhibitor of g protein-coupled receptor kinase 2 and increases myocardial contractility. Acs Chem.Biol., 7, 2012
3UFD	C.Esp1396I bound to its highest affinity operator site OM Descriptor: CHLORIDE ION, DNA (5'-D(*AP*TP*GP*TP*AP*GP*AP*CP*TP*AP*TP*AP*GP*TP*CP*GP*AP*CP*A)-3'), DNA (5'-D(*TP*TP*GP*TP*CP*GP*AP*CP*TP*AP*TP*AP*GP*TP*CP*TP*AP*CP*A)-3'), ... Authors: Ball, N.J, McGeehan, J.E, Streeter, S.D, Thresh, S.-J, Kneale, G.G. Deposit date: 2011-11-01 Release date: 2012-07-11 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.8 Å) Cite: The structural basis of differential DNA sequence recognition by restriction-modification controller proteins. Nucleic Acids Res., 40, 2012
4FKW	Crystal structure of the cdk2 in complex with oxindole inhibitor Descriptor: 2-methylpropyl (3Z)-2-oxo-3-[2-(4-sulfamoylphenyl)hydrazinylidene]-2,3-dihydro-1H-indole-5-carboxylate, Cyclin-dependent kinase 2, GLYCEROL Authors: Kang, Y.N, Stuckey, J.A. Deposit date: 2012-06-13 Release date: 2013-05-08 Last modified: 2013-05-22 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Crystal structure of the cdk2 in complex with oxindole inhibitor To be Published
4FI5	Crystal structure of the N-terminal domain of Hantaan virus strain 76-118 nucleoprotein Descriptor: Nucleoprotein Authors: Seattle Structural Genomics Center for Infectious Disease (SSGCID) Deposit date: 2012-06-07 Release date: 2012-06-20 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Crystal structure of the N-terminal domain of Hantaan virus strain 76-118 nucleoprotein TO BE PUBLISHED
4FIC	Kinase domain of cSrc in complex with a hinge region-binding fragment Descriptor: 6-phenyl[1,2,4]triazolo[1,5-a]pyrazin-2-amine, Proto-oncogene tyrosine-protein kinase Src Authors: Richters, A, Rauh, D. Deposit date: 2012-06-08 Release date: 2013-04-10 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2.5 Å) Cite: De novo design of protein kinase inhibitors by in silico identification of hinge region-binding fragments. Acs Chem.Biol., 8, 2013
3V6N	Crystal structure of a plant albumin from Cicer Arietinum showing hemagglutination Descriptor: CALCIUM ION, CHLORIDE ION, IODIDE ION, ... Authors: Sharma, U, Suresh, C.G. Deposit date: 2011-12-20 Release date: 2012-01-04 Last modified: 2023-11-08 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Crystal structure of a plant albumin from Cicer arietinum (chickpea) possessing hemopexin fold and hemagglutination activity Planta, 2015
4FL5	Crystal structure of human 14-3-3 sigma in complex with a Tau-protein peptide surrounding pS214 Descriptor: 14-3-3 protein sigma, CALCIUM ION, CHLORIDE ION, ... Authors: Schumacher, B, Ottmann, C. Deposit date: 2012-06-14 Release date: 2013-12-11 Last modified: 2017-06-07 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Involvement of 14-3-3 in tubulin instability and impaired axon development is mediated by Tau. FASEB J., 29, 2015
4FLM	S-formylglutathione Hydrolase W197I Variant containing Copper Descriptor: COPPER (II) ION, S-formylglutathione hydrolase Authors: Legler, P.M, Millard, C.B. Deposit date: 2012-06-14 Release date: 2012-09-05 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2.41 Å) Cite: A role for His-160 in peroxide inhibition of S. cerevisiae S-formylglutathione hydrolase: Evidence for an oxidation sensitive motif. Arch.Biochem.Biophys., 528, 2012
3V70	Crystal Structure of Human GTPase IMAP family member 1 Descriptor: GTPase IMAP family member 1, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION Authors: Nedyalkova, L, Shen, Y, Tong, Y, Tempel, W, Mackenzie, F, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Weigelt, J, Bochkarev, A, Andrews, D.W, Park, H, Structural Genomics Consortium (SGC) Deposit date: 2011-12-20 Release date: 2012-01-11 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2.206 Å) Cite: Crystal Structure of Human GTPase IMAP family member 1 to be published
4FMF	Crystal structure of human nectin-1 full ectodomain (D1-D3) Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, FORMIC ACID, Poliovirus receptor-related protein 1 Authors: Harrison, O.J, Brasch, J, Shapiro, L. Deposit date: 2012-06-16 Release date: 2012-08-22 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (3.2 Å) Cite: Nectin ectodomain structures reveal a canonical adhesive interface. Nat.Struct.Mol.Biol., 19, 2012
3UIQ	RB69 DNA Polymerase Ternary Complex containing dUpNpp Descriptor: 2'-DEOXYURIDINE 5'-ALPHA,BETA-IMIDO-TRIPHOSPHATE, 5'-D(*GP*CP*GP*GP*AP*CP*TP*GP*CP*TP*TP*AP*C)-3', 5'-D(*TP*CP*GP*AP*GP*TP*AP*AP*GP*CP*AP*GP*TP*CP*CP*GP*CP*G)-3', ... Authors: Xia, S, Konigsberg, W.H, Wang, J. Deposit date: 2011-11-05 Release date: 2012-04-18 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.879 Å) Cite: Bidentate and tridentate metal-ion coordination states within ternary complexes of RB69 DNA polymerase. Protein Sci., 21, 2012
4FON	High Energy Remote SAD structure solution of Proteinase K from the 37.8 keV Tellurium K edge Descriptor: 1,2-ETHANEDIOL, CALCIUM ION, OXYGEN ATOM, ... Authors: Jakoncic, J. Deposit date: 2012-06-20 Release date: 2012-08-22 Method: X-RAY DIFFRACTION (1.05 Å) Cite: Macromolecular Crystallography at High(er) Energy To be Published
3UJR	Asymmetric complex of human neuron specific enolase-5-PGA/PEP Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 2-PHOSPHOGLYCERIC ACID, Gamma-enolase, ... Authors: Qin, J, Chai, G, Brewer, J, Lovelace, L, Lebioda, L. Deposit date: 2011-11-08 Release date: 2012-08-22 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.4 Å) Cite: Structures of asymmetric complexes of human neuron specific enolase with resolved substrate and product and an analogous complex with two inhibitors indicate subunit interaction and inhibitor cooperativity. J.Inorg.Biochem., 111, 2012
3UEW	Bovine beta-lactoglobulin complex with palmitic acid Descriptor: Beta-lactoglobulin, ETHANOL, PALMITIC ACID Authors: Loch, J, Lewinski, K. Deposit date: 2011-10-31 Release date: 2011-11-09 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2 Å) Cite: Bovine beta-lactoglobulin complex with palmitic acid Int.J.Biol.Macromol., 50, 2012
4FK8	Crystal structure of FERREDOXIN-NADP REDUCTASE from burkholderia thailandensis E264 with bound FAD Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, Ferredoxin--NADP reductase Authors: Seattle Structural Genomics Center for Infectious Disease (SSGCID) Deposit date: 2012-06-12 Release date: 2012-06-20 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Combining functional and structural genomics to sample the essential Burkholderia structome. Plos One, 8, 2013
4FPW	Crystal Structure of CalU16 from Micromonospora echinospora. Northeast Structural Genomics Consortium Target MiR12. Descriptor: CalU16 Authors: Seetharaman, J, Lew, S, Janjua, H, Xiao, R, Acton, T.B, Everett, J.K, Phillips Jr, G.N, Kennedy, M.A, Montelione, G.T, Hunt, J.F, Tong, L, Northeast Structural Genomics Consortium (NESG) Deposit date: 2012-06-22 Release date: 2012-12-12 Last modified: 2014-11-12 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Structure-Guided Functional Characterization of Enediyne Self-Sacrifice Resistance Proteins, CalU16 and CalU19. Acs Chem.Biol., 9, 2014

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