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3U69
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BU of 3u69 by Molmil
Unliganded wild-type human thrombin
分子名称: (4R)-2-METHYLPENTANE-2,4-DIOL, (4S)-2-METHYL-2,4-PENTANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Figueiredo, A.C, Clement, C.C, Philipp, M, Barbosa Pereira, P.J.
登録日2011-10-12
公開日2012-04-11
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Rational design and characterization of d-phe-pro-d-arg-derived direct thrombin inhibitors.
Plos One, 7, 2012
3CZ3
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BU of 3cz3 by Molmil
Crystal structure of Tomato Aspermy Virus 2b in complex with siRNA
分子名称: Protein 2b, RNA (5'-R(P*CP*GP*UP*AP*CP*GP*CP*GP*GP*AP*AP*UP*AP*CP*UP*UP*CP*GP*A)-3'), RNA (5'-R(P*UP*CP*GP*AP*AP*GP*UP*AP*UP*UP*CP*CP*GP*CP*GP*UP*AP*CP*G)-3')
著者Ma, J.B, Li, F, Ding, S.W, Patel, D.J.
登録日2008-04-27
公開日2009-05-05
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (3.23 Å)
主引用文献Structural Basis for siRNA Recognition by 2b, a Viral Suppressor of Non-Cell Autonomous RNA Silencing
To be Published
3D0X
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BU of 3d0x by Molmil
Crystal Structure of the unbound lysine riboswitch
分子名称: RNA (161-MER)
著者Batey, R.T, Garst, A.D, Heroux, A, Rambo, R.P.
登録日2008-05-02
公開日2008-07-01
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.95 Å)
主引用文献Crystal structure of the lysine riboswitch regulatory mRNA element.
J.Biol.Chem., 283, 2008
3D1O
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BU of 3d1o by Molmil
Structure of the PTP-Like Phytase Expressed by Selenomonas Ruminantium at an Ionic Strength of 300 mM
分子名称: CHLORIDE ION, GLYCEROL, Myo-inositol hexaphosphate phosphohydrolase
著者Gruninger, R.J, Selinger, L.B, Mosimann, S.C.
登録日2008-05-06
公開日2008-06-24
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Effect of ionic strength and oxidation on the P-loop conformation of the protein tyrosine phosphatase-like phytase, PhyAsr.
Febs J., 275, 2008
3UA6
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BU of 3ua6 by Molmil
Crystal Structure of the Human Fyn SH3 domain
分子名称: FORMIC ACID, GLYCEROL, SODIUM ION, ...
著者Camara-Artigas, A, Martin-Garcia, J.M.
登録日2011-10-21
公開日2012-07-25
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献The promiscuous binding of the Fyn SH3 domain to a peptide from the NS5A protein.
Acta Crystallogr.,Sect.D, 68, 2012
3D7C
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BU of 3d7c by Molmil
Crystal structure of the bromodomain of human GCN5, the general control of amino-acid synthesis protein 5-like 2
分子名称: General control of amino acid synthesis protein 5-like 2
著者Filippakopoulos, P, Eswaran, J, Picaud, S, Fedorov, O, Murray, J, von Delft, F, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Knapp, S, Structural Genomics Consortium (SGC)
登録日2008-05-21
公開日2008-07-15
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.06 Å)
主引用文献Histone recognition and large-scale structural analysis of the human bromodomain family.
Cell(Cambridge,Mass.), 149, 2012
3TRI
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BU of 3tri by Molmil
Structure of a pyrroline-5-carboxylate reductase (proC) from Coxiella burnetii
分子名称: CHLORIDE ION, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, PHOSPHATE ION, ...
著者Cheung, J, Franklin, M.C, Rudolph, M, Cassidy, M, Gary, E, Burshteyn, F, Love, J.
登録日2011-09-09
公開日2011-09-28
最終更新日2017-11-08
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
3CEQ
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BU of 3ceq by Molmil
The TPR domain of Human Kinesin Light Chain 2 (hKLC2)
分子名称: Kinesin light chain 2
著者Zhu, H, Shen, Y, MacKenzie, F, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Weigelt, J, Bochkarev, A, Park, H, Structural Genomics Consortium (SGC)
登録日2008-02-29
公開日2008-08-12
最終更新日2017-10-25
実験手法X-RAY DIFFRACTION (2.75 Å)
主引用文献The TPR domain of Human Kinesin Light Chain 2 (hKLC2)
To be Published
3CHW
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BU of 3chw by Molmil
Complex of Dictyostelium discoideum Actin with Profilin and the Last Poly-Pro of Human VASP
分子名称: ADENOSINE-5'-TRIPHOSPHATE, CALCIUM ION, Major actin, ...
著者Baek, K, Dominguez, R.
登録日2008-03-10
公開日2008-08-19
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Modulation of actin structure and function by phosphorylation of Tyr-53 and profilin binding.
Proc.Natl.Acad.Sci.Usa, 105, 2008
3CI9
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BU of 3ci9 by Molmil
Crystal Structure of the human HSBP1
分子名称: Heat shock factor-binding protein 1
著者Liu, X, Xu, L, Liu, Y, Zhu, G, Zhang, X.C, Li, X, Rao, Z.
登録日2008-03-11
公開日2009-01-20
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal structure of the hexamer of human heat shock factor binding protein 1
Proteins, 75, 2009
3CIS
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BU of 3cis by Molmil
The Crystal Structure of Rv2623 from Mycobacterium tuberculosis
分子名称: ADENOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, Uncharacterized protein
著者Bilder, P, Drumm, J, Mi, K, Chan, J, Almo, S.C.
登録日2008-03-11
公開日2009-03-17
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献The Crystal Structure of Rv2623 : a Novel, Tandem-Repeat Universal Stress Protein of Mycobacterium tuberculosis
To be Published
3CKP
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BU of 3ckp by Molmil
Crystal structure of BACE-1 in complex with inhibitor
分子名称: (4S)-N-[(1S,2R)-1-benzyl-3-{[3-(dimethylamino)benzyl]amino}-2-hydroxypropyl]-1-(3-methoxybenzyl)-2-oxoimidazolidine-4-carboxamide, Beta-secretase 1, CHLORIDE ION
著者Min, K.
登録日2008-03-16
公開日2008-06-03
最終更新日2021-11-10
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Synthesis, SAR, and X-ray structure of human BACE-1 inhibitors with cyclic urea derivatives
Bioorg.Med.Chem.Lett., 18, 2008
3CKC
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BU of 3ckc by Molmil
B. thetaiotaomicron SusD
分子名称: 1,2-ETHANEDIOL, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, ...
著者Koropatkin, N.M, Martens, E.C, Gordon, J.I, Smith, T.J.
登録日2008-03-14
公開日2008-04-01
最終更新日2017-10-25
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Starch catabolism by a prominent human gut symbiont is directed by the recognition of amylose helices.
Structure, 16, 2008
3U1N
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BU of 3u1n by Molmil
Structure of the catalytic core of human SAMHD1
分子名称: PHOSPHATE ION, SAM domain and HD domain-containing protein 1, ZINC ION
著者Goldstone, D.C, Ennis-Adeniran, V, Walker, P.A, Haire, L.F, Webb, M, Taylor, I.A.
登録日2011-09-30
公開日2011-11-16
最終更新日2018-01-24
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献HIV-1 restriction factor SAMHD1 is a deoxynucleoside triphosphate triphosphohydrolase
Nature, 480, 2011
3CPL
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BU of 3cpl by Molmil
Crystal Structure of H-2Db in complex with a variant M6A of the NP366 peptide from influenza A virus
分子名称: Beta-2-microglobulin, H-2 class I histocompatibility antigen, D-B alpha chain, ...
著者Kedzierska, K, Guillonneau, C, Hatton, L.A, Stockwell, D, Gras, S, Webby, R, Rossjohn, J, Purcell, A.W, Doherty, P.C, Turner, S.J.
登録日2008-03-31
公開日2008-11-18
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Complete modification of TCR specificity and repertoire selection does not perturb a CD8+ T cell immunodominance hierarchy.
Proc.Natl.Acad.Sci.USA, 105, 2008
3U7V
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BU of 3u7v by Molmil
The structure of a putative Beta-galactosidase from Caulobacter crescentus CB15.
分子名称: ACETIC ACID, Beta-galactosidase
著者Cuff, M.E, Tesar, C, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2011-10-14
公開日2011-12-21
最終更新日2017-11-08
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献The structure of a putative Beta-galactosidase from Caulobacter crescentus CB15.
TO BE PUBLISHED
3U2K
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S. aureus GyrB ATPase domain in complex with a small molecule inhibitor
分子名称: 2-chloro-6-(4-{[(3,4-dichloro-5-methyl-1H-pyrrol-2-yl)carbonyl]amino}piperidin-1-yl)pyridine-4-carboxamide, DNA gyrase subunit B, MAGNESIUM ION
著者Boriack-Sjodin, P.A, Prince, D.B, Eakin, A.E, Sherer, B.A.
登録日2011-10-03
公開日2012-01-11
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.64 Å)
主引用文献Pyrrolamide DNA gyrase inhibitors: fragment-based nuclear magnetic resonance screening to identify antibacterial agents.
Antimicrob.Agents Chemother., 56, 2012
3QIK
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BU of 3qik by Molmil
Crystal structure of the first PDZ domain of PREX1
分子名称: Phosphatidylinositol 3,4,5-trisphosphate-dependent Rac exchanger 1 protein, UNKNOWN ATOM OR ION
著者Shen, L, Tong, Y, Tempel, W, Li, Y, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Weigelt, J, Park, H, Structural Genomics Consortium (SGC)
登録日2011-01-27
公開日2011-02-16
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.285 Å)
主引用文献Crystal structure of the first PDZ domain of PREX1
to be published
3QGA
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3.0 A Model of Iron Containing Urease UreA2B2 from Helicobacter mustelae
分子名称: FE (III) ION, Fusion of urease beta and gamma subunits, Urease subunit beta 2
著者Tronrud, D.E, Robbins, A, Karplus, P.A.
登録日2011-01-24
公開日2011-08-10
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Iron-containing urease in a pathogenic bacterium.
Proc.Natl.Acad.Sci.USA, 108, 2011
3QXZ
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Crystal structure of a probable enoyl-CoA hydratase/isomerase from Mycobacterium abscessus
分子名称: 1,2-ETHANEDIOL, GLYCEROL, POTASSIUM ION, ...
著者Seattle Structural Genomics Center for Infectious Disease (SSGCID)
登録日2011-03-02
公開日2011-03-16
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献Increasing the structural coverage of tuberculosis drug targets.
Tuberculosis (Edinb), 95, 2015
3QHR
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BU of 3qhr by Molmil
Structure of a pCDK2/CyclinA transition-state mimic
分子名称: ADENOSINE-5'-DIPHOSPHATE, CDK2 substrate peptide: PKTPKKAKKL, CHLORIDE ION, ...
著者Young, M.A, Jacobsen, D.M, Bao, Z.Q.
登録日2011-01-26
公開日2011-05-25
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.17 Å)
主引用文献Briefly Bound to Activate: Transient Binding of a Second Catalytic Magnesium Activates the Structure and Dynamics of CDK2 Kinase for Catalysis.
Structure, 19, 2011
3UA7
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Crystal Structure of the Human Fyn SH3 domain in complex with a peptide from the Hepatitis C virus NS5A-protein
分子名称: CHLORIDE ION, FORMIC ACID, GLYCEROL, ...
著者Martin-Garcia, J.M, Ruiz-Sanz, J, Luque, I, Camara-Artigas, A.
登録日2011-10-21
公開日2012-07-25
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献The promiscuous binding of the Fyn SH3 domain to a peptide from the NS5A protein.
Acta Crystallogr.,Sect.D, 68, 2012
3TI7
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Crystal structure of the basic protease BprV from the ovine footrot pathogen, Dichelobacter nodosus
分子名称: Basic extracellular subtilisin-like protease BprV, CALCIUM ION
著者Wong, W, Whisstock, J.C, Porter, C.J.
登録日2011-08-20
公開日2011-10-19
最終更新日2018-01-24
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献S1 Pocket of a Bacterially Derived Subtilisin-like Protease Underpins Effective Tissue Destruction.
J.Biol.Chem., 286, 2011
3TK3
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Cytochrome P450 2B4 mutant L437A in complex with 4-(4-chlorophenyl)imidazole
分子名称: 4-(4-CHLOROPHENYL)IMIDAZOLE, Cytochrome P450 2B4, PROTOPORPHYRIN IX CONTAINING FE
著者Gay, S.C, Jang, H.H, Wilderman, P.R, Zhang, Q, Stout, C.D, Halpert, J.R.
登録日2011-08-25
公開日2011-11-16
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.8001 Å)
主引用文献Investigation by site-directed mutagenesis of the role of cytochrome P450 2B4 non-active-site residues in protein-ligand interactions based on crystal structures of the ligand-bound enzyme.
Febs J., 279, 2012
3TR3
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Structure of a bolA protein homologue from Coxiella burnetii
分子名称: BolA, COBALT (II) ION
著者Cheung, J, Franklin, M.C, Rudolph, M, Cassidy, M, Gary, E, Burshteyn, F, Love, J.
登録日2011-09-09
公開日2011-09-28
最終更新日2017-11-08
実験手法X-RAY DIFFRACTION (2.456 Å)
主引用文献Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015

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