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2RBX
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Cytochrome C Peroxidase W191G in complex with pyrimidine-2,4,6-triamine.
分子名称: Cytochrome C Peroxidase, PHOSPHATE ION, PROTOPORPHYRIN IX CONTAINING FE, ...
著者Graves, A.P, Boyce, S.E, Shoichet, B.K.
登録日2007-09-19
公開日2008-04-01
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Rescoring docking hit lists for model cavity sites: predictions and experimental testing.
J.Mol.Biol., 377, 2008
4F1S
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BU of 4f1s by Molmil
Crystal structure of human PI3K-gamma in complex with a pyridyl-triazine-sulfonamide inhibitor
分子名称: N-(5-{[3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-5-(tetrahydro-2H-pyran-4-yl)pyridin-2-yl]amino}-2-chloropyridin-3-yl)methanesulfonamide, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, SULFATE ION
著者Whittington, D.A, Tang, J, Yakowec, P.
登録日2012-05-07
公開日2012-08-08
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Synthesis and structure-activity relationships of dual PI3K/mTOR inhibitors based on a 4-amino-6-methyl-1,3,5-triazine sulfonamide scaffold.
Bioorg.Med.Chem.Lett., 22, 2012
4F2K
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BU of 4f2k by Molmil
Macrophage Migration Inhibitory Factor covalently complexed with phenethylisothiocyanate
分子名称: ISOPROPYL ALCOHOL, Macrophage migration inhibitory factor, N-(2-phenylethyl)thioformamide, ...
著者Tyndall, J.D.A, Bernhagen, J, Hampton, M.B, Wilbanks, S.M, Rutledge, M.T.
登録日2012-05-08
公開日2012-06-06
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.53 Å)
主引用文献Macrophage migration inhibitory factor covalently complexed with phenethyl isothiocyanate
Acta Crystallogr.,Sect.F, 68, 2012
2RDE
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BU of 2rde by Molmil
Crystal structure of VCA0042 complexed with c-di-GMP
分子名称: 9,9'-[(2R,3R,3aS,5S,7aR,9R,10R,10aS,12S,14aR)-3,5,10,12-tetrahydroxy-5,12-dioxidooctahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8]tetraoxadiphosphacyclododecine-2,9-diyl]bis(2-amino-1,9-dihydro-6H-purin-6-one), Uncharacterized protein VCA0042
著者Benach, J, Swaminathan, S.S, Tamayo, R, Seetharaman, J, Handelman, S, Forouhar, F, Neely, H, Camilli, A, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
登録日2007-09-22
公開日2007-10-30
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.92 Å)
主引用文献The structural basis of cyclic diguanylate signal transduction by PilZ domains.
Embo J., 26, 2007
2IA1
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BU of 2ia1 by Molmil
Crystal structure of protein BH3703 from Bacillus halodurans, Pfam DUF600
分子名称: BH3703 protein, GLYCEROL, SULFATE ION
著者Ramagopal, U.A, Russell, M, Toro, R, Freeman, J.C, Reyes, C, Gheyi, T, Sauder, J.M, Burley, S.K, Almo, S.C, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2006-09-06
公開日2006-10-03
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.59 Å)
主引用文献Structure of hypothetical protein BH3703 from Bacillus halodurans
To be Published
4F3M
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BU of 4f3m by Molmil
Crystal structure of CRISPR-associated protein
分子名称: 1,2-ETHANEDIOL, BH0337 protein, SULFATE ION
著者Ke, A, Nam, K.H.
登録日2012-05-09
公開日2012-08-15
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.71 Å)
主引用文献Cas5d Protein Processes Pre-crRNA and Assembles into a Cascade-like Interference Complex in Subtype I-C/Dvulg CRISPR-Cas System.
Structure, 20, 2012
3OTC
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BU of 3otc by Molmil
Crystal structure of human tRNAHis guanylyltransferase (Thg1)- Native II
分子名称: tRNA(His) guanylyltransferase
著者Hyde, S.J, Eckenroth, B.E, Doublie, S.
登録日2010-09-11
公開日2010-11-17
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (3.01 Å)
主引用文献tRNAHis guanylyltransferase (THG1), a unique 3'-5' nucleotidyl transferase, shares unexpected structural homology with canonical 5'-3' DNA polymerases.
Proc.Natl.Acad.Sci.USA, 107, 2010
4EZ5
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BU of 4ez5 by Molmil
CDK6 (monomeric) in complex with inhibitor
分子名称: Cyclin-dependent kinase 6, {5-[4-(dimethylamino)piperidin-1-yl]-1H-imidazo[4,5-b]pyridin-2-yl}[2-(isoquinolin-4-yl)pyridin-4-yl]methanone
著者Chopra, R, Xu, M.
登録日2012-05-02
公開日2013-02-06
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Fragment-Based Discovery of 7-Azabenzimidazoles as Potent, Highly Selective, and Orally Active CDK4/6 Inhibitors.
ACS Med Chem Lett, 3, 2012
2RJZ
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BU of 2rjz by Molmil
Crystal structure of the type 4 fimbrial biogenesis protein PilO from Pseudomonas aeruginosa
分子名称: PilO protein, SULFATE ION
著者Bonanno, J.B, Freeman, J, Bain, K.T, Chang, S, Ozyurt, S, Smith, D, Wasserman, S, Sauder, J.M, Burley, S.K, Almo, S.C, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2007-10-16
公開日2007-11-06
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Periplasmic domains of Pseudomonas aeruginosa PilN and PilO form a stable heterodimeric complex.
J.Mol.Biol., 394, 2009
2I5K
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BU of 2i5k by Molmil
Crystal structure of Ugp1p
分子名称: UTP--glucose-1-phosphate uridylyltransferase
著者Roeben, A, Plitzko, J.M, Koerner, R, Boettcher, U.M.K, Siegers, K, Hayer-Hartl, M, Bracher, A.
登録日2006-08-25
公開日2006-11-28
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献Structural Basis for Subunit Assembly in UDP-glucose Pyrophosphorylase from Saccharomyces cerevisiae
J.Mol.Biol., 364, 2006
3OW6
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BU of 3ow6 by Molmil
Crystal Structure of HSP90 with N-Aryl-benzimidazolone I
分子名称: 1-(2,4-dihydroxyphenyl)-1,3-dihydro-2H-benzimidazol-2-one, Heat shock protein HSP 90-alpha
著者Park, C.H.
登録日2010-09-17
公開日2011-09-21
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献N-aryl-benzimidazolones as novel small molecule HSP90 inhibitors.
Bioorg.Med.Chem.Lett., 20, 2010
4F8R
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BU of 4f8r by Molmil
Bacillus DNA Polymerase I Large Fragment complex 7
分子名称: DNA (5'-D(*CP*AP*TP*TP*CP*GP*AP*GP*TP*CP*AP*GP*G)-3'), DNA (5'-D(*CP*CP*TP*GP*AP*CP*TP*CP*(DDG))-3'), DNA polymerase, ...
著者Wang, W, Beese, L.S.
登録日2012-05-17
公開日2013-08-07
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.64 Å)
主引用文献Structures of a High-fidelity DNA Polymerase
to be published
3OWF
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BU of 3owf by Molmil
Crystal structure of Staphylococcal nuclease variant Delta+PHS V66R at cryogenic temperature
分子名称: CALCIUM ION, PHOSPHATE ION, THYMIDINE-3',5'-DIPHOSPHATE, ...
著者Schlessman, J.L, Khangulov, V, Heroux, A, Garcia-Moreno E, B.
登録日2010-09-17
公開日2010-10-20
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Domain swapping promoted by a single mutation that introduces an ionizable group into the hydrophobic core of a protein
To be Published
3P1C
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BU of 3p1c by Molmil
Crystal structure of the bromodomain of human CREBBP in complex with acetylated lysine
分子名称: CREB-binding protein, N(6)-ACETYLLYSINE, POTASSIUM ION, ...
著者Filippakopoulos, P, Picaud, S, Feletar, I, Fedorov, O, Muniz, J, von Delft, F, Arrowsmith, C.H, Edwards, A.M, Weigelt, J, Bountra, C, Knapp, S, Structural Genomics Consortium (SGC)
登録日2010-09-30
公開日2010-11-24
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (1.82 Å)
主引用文献Histone recognition and large-scale structural analysis of the human bromodomain family.
Cell(Cambridge,Mass.), 149, 2012
2I7Q
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BU of 2i7q by Molmil
Crystal structure of Human Choline Kinase A
分子名称: CHLORIDE ION, Choline kinase alpha, UNKNOWN ATOM OR ION
著者Rabeh, W.M, Tempel, W, Nedyalkova, L, Wasney, G, Landry, R, Arrowsmith, C.H, Edwards, A.M, Sundstrom, M, Weigelt, J, Bochkarev, A, Park, H, Structural Genomics Consortium (SGC)
登録日2006-08-31
公開日2006-09-12
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Crystal structure of Human Choline Kinase A
To be Published
2R5F
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BU of 2r5f by Molmil
Putative sugar-binding domain of transcriptional regulator DeoR from Pseudomonas syringae pv. tomato
分子名称: SULFATE ION, Transcriptional regulator, putative
著者Cuff, M.E, Duggan, E, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2007-09-03
公開日2007-09-18
最終更新日2017-10-25
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Putative sugar-binding domain of trancsriptional regulator DeoR from Pseudomonas syringae pv. tomato.
TO BE PUBLISHED
2I99
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BU of 2i99 by Molmil
Crystal structure of human Mu_crystallin at 2.6 Angstrom
分子名称: Mu-crystallin homolog, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
著者Cheng, Z, Sun, L, He, J, Gong, W.
登録日2006-09-05
公開日2007-02-27
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Crystal structure of human {micro}-crystallin complexed with NADPH
Protein Sci., 16, 2007
3P0F
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Structure of hUPP2 in an inactive conformation with bound 5-benzylacyclouridine
分子名称: 1-((2-HYDROXYETHOXY)METHYL)-5-BENZYLPYRIMIDINE-2,4(1H,3H)-DIONE, COBALT (II) ION, MAGNESIUM ION, ...
著者Roosild, T.P, Castronovo, S, Villoso, A.
登録日2010-09-28
公開日2011-09-07
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.54 Å)
主引用文献A novel structural mechanism for redox regulation of uridine phosphorylase 2 activity.
J.Struct.Biol., 176, 2011
3P1U
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BU of 3p1u by Molmil
Crystal structure of a SusD homolog (BDI_0600) from Parabacteroides distasonis ATCC 8503 AT 2.05 A resolution
分子名称: SULFATE ION, SusD homolog
著者Joint Center for Structural Genomics (JCSG)
登録日2010-09-30
公開日2010-11-03
最終更新日2023-02-01
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Crystal structure of a SusD homolog (YP_001301998.1) from Parabacteroides distasonis ATCC 8503 at 2.05 A resolution
To be published
3P6C
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BU of 3p6c by Molmil
Human adipocyte lipid-binding protein FABP4 in complex with citric acid
分子名称: CITRIC ACID, Fatty acid-binding protein, adipocyte
著者Gonzalez, J.M, Pozharski, E.
登録日2010-10-11
公開日2011-04-13
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.25 Å)
主引用文献Structural analysis of ibuprofen binding to human adipocyte fatty-acid binding protein (FABP4).
Acta Crystallogr F Struct Biol Commun, 71, 2015
3P6K
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BU of 3p6k by Molmil
Crystal structure of a PLP-dependent aminotransferase (ZP_03625122.1) from Streptococcus suis 89-1591 at 2.07 A resolution
分子名称: 1,2-ETHANEDIOL, Aminotransferase class I and II, SULFATE ION, ...
著者Joint Center for Structural Genomics (JCSG)
登録日2010-10-11
公開日2010-10-27
最終更新日2023-02-01
実験手法X-RAY DIFFRACTION (2.07 Å)
主引用文献Crystal structure of a PLP-dependent aminotransferase (ZP_03625122.1) from Streptococcus suis 89-1591 at 2.07 A resolution
To be published
4EZD
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BU of 4ezd by Molmil
Crystal Structure of the UT-B Urea Transporter from Bos Taurus Bound to Selenourea
分子名称: OCTANOIC ACID (2-HYDROXY-1-HYDROXYMETHYL-HEPTADEC-3-ENYL)-AMIDE, Urea transporter 1, beta-D-glucopyranose, ...
著者Cao, Y, Levin, E.J, Zhou, M, New York Consortium on Membrane Protein Structure (NYCOMPS)
登録日2012-05-02
公開日2012-06-27
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structure and permeation mechanism of a mammalian urea transporter.
Proc.Natl.Acad.Sci.USA, 109, 2012
2I2O
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Crystal Structure of an eIF4G-like Protein from Danio rerio
分子名称: NICKEL (II) ION, eIF4G-like protein
著者Bitto, E, Wesenberg, G.E, Phillips Jr, G.N, Mccoy, J.G, Bingman, C.A, Center for Eukaryotic Structural Genomics (CESG)
登録日2006-08-16
公開日2006-08-29
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.92 Å)
主引用文献Crystal structure of an eIF4G-like protein from Danio rerio.
Proteins, 78, 2010
2I3P
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K28R mutant of Homing Endonuclease I-CreI
分子名称: 5'-D(*CP*GP*AP*AP*AP*TP*TP*GP*TP*CP*TP*CP*AP*CP*GP*AP*CP*GP*AP*TP*TP*TP*GP*C)-3', 5'-D(*GP*CP*AP*AP*AP*TP*CP*GP*TP*CP*GP*TP*GP*AP*GP*AP*CP*AP*AP*TP*TP*TP*CP*G)-3', CALCIUM ION, ...
著者Sussman, D, Rosen, L.
登録日2006-08-20
公開日2006-09-05
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Homing endonuclease I-CreI derivatives with novel DNA target specificities.
Nucleic Acids Res., 34, 2006
3P7P
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Radiation damage study of thermolysin - 100K structure A (0.1 MGy)
分子名称: CALCIUM ION, Thermolysin, ZINC ION
著者Juers, D.H, Weik, M.
登録日2010-10-12
公開日2010-12-08
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Radiation damage study of thermolysin - 100K structure A (0.1 MGy)
To be Published

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