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4IJK
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BU of 4ijk by Molmil
Crystal structure of a putative 3-oxoacyl-[acyl-carrier protein]reductase from Helicobacter pylori 26695
分子名称: 3-ketoacyl-acyl carrier protein reductase (FabG), SODIUM ION
著者Hou, J, Osinski, T, Zheng, H, Shumilin, I, Shabalin, I.G, Shatsman, S, Anderson, W.F, Minor, W, Center for Structural Genomics of Infectious Diseases (CSGID)
登録日2012-12-21
公開日2013-01-09
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.54 Å)
主引用文献Crystal structure of a putative 3-oxoacyl-[acyl-carrier protein]reductase from Helicobacter pylori 26695
To be Published
4IE7
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BU of 4ie7 by Molmil
Crystal structure of the human fat mass and obesity associated protein (FTO) in complex with citrate and rhein (RHN)
分子名称: 4,5-dihydroxy-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid, Alpha-ketoglutarate-dependent dioxygenase FTO, CITRATE ANION, ...
著者Aik, W.S, McDonough, M.A, Schofield, C.J.
登録日2012-12-13
公開日2013-04-03
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.6004 Å)
主引用文献Structural basis for inhibition of the fat mass and obesity associated protein (FTO)
J.Med.Chem., 56, 2013
4IFG
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BU of 4ifg by Molmil
Crystal structure of TgCDPK1 with inhibitor bound
分子名称: 1-{(3R)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl}prop-2-en-1-one, Calmodulin-domain protein kinase 1, UNKNOWN ATOM OR ION
著者El Bakkouri, M, Tempel, W, Crandall, I, Massad, T, Loppnau, P, Graslund, S, Bountra, C, Arrowsmith, C.H, Edwards, A.M, Kain, K, Hui, R, Structural Genomics Consortium (SGC)
登録日2012-12-14
公開日2014-04-16
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.11 Å)
主引用文献Crystal structure of TgCDPK1 with inhibitor bound
To be Published
4INC
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BU of 4inc by Molmil
Human Histidine Triad Nucleotide Binding Protein 2
分子名称: CHLORIDE ION, Histidine triad nucleotide-binding protein 2, mitochondrial
著者Maize, K.M, Wagner, C.R, Finzel, B.C.
登録日2013-01-04
公開日2013-05-22
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.19 Å)
主引用文献Structural characterization of human histidine triad nucleotide-binding protein 2, a member of the histidine triad superfamily.
Febs J., 280, 2013
4IG6
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BU of 4ig6 by Molmil
Crystal structure of a tRNA (guanine-N1)-methyltransferase from Anaplasma phagocytophilum bound to S-adenosylhomocysteine
分子名称: CHLORIDE ION, S-ADENOSYL-L-HOMOCYSTEINE, tRNA (guanine-N(1)-)-methyltransferase
著者Seattle Structural Genomics Center for Infectious Disease (SSGCID)
登録日2012-12-16
公開日2012-12-26
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Crystal structure of a tRNA (guanine-N1)-methyltransferase from Anaplasma phagocytophilum bound to S-adenosylhomocysteine
TO BE PUBLISHED
4IHX
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BU of 4ihx by Molmil
Crystal structure of Fis bound to 27 bp 2-Aminopurine substituted DNA F28-2AP (AAATTTGTTTGA2T2TTGAGCAAATTT)
分子名称: 27-bp DNA Strand A, 27-bp DNA Strand B, DNA-binding protein fis
著者Hancock, S.P, Cascio, D, Johnson, R.C.
登録日2012-12-19
公開日2013-05-01
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Control of DNA minor groove width and Fis protein binding by the purine 2-amino group.
Nucleic Acids Res., 41, 2013
4IE6
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BU of 4ie6 by Molmil
Crystal structure of the human fat mass and obesity associated protein (FTO) in complex with N-[(1-chloro-4-hydroxyisoquinolin-3-yl)carbonyl]glycine (IOX3/UN9)
分子名称: Alpha-ketoglutarate-dependent dioxygenase FTO, N-[(1-CHLORO-4-HYDROXYISOQUINOLIN-3-YL)CARBONYL]GLYCINE, ZINC ION
著者Aik, W.S, McDonough, M.A, Schofield, C.J.
登録日2012-12-13
公開日2013-04-03
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.5036 Å)
主引用文献Structural basis for inhibition of the fat mass and obesity associated protein (FTO)
J.Med.Chem., 56, 2013
4GN2
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BU of 4gn2 by Molmil
Crystal Structure of OXA-45, a Class D beta-lactamase with extended spectrum activity
分子名称: Oxacillinase
著者Martin, J.D, Xiong, X.L, Catto, L.E, Toleman, M.A, Walsh, T.R, Clarke, A.R, Spencer, J.
登録日2012-08-16
公開日2013-08-21
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (2.01 Å)
主引用文献Structural and Kinetic Characterization of OXA-45, a Class D beta-Lactamase with Extended Spectrum activity
To be Published
4GBW
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BU of 4gbw by Molmil
Crystal Structure of AMP complexes of Porcine Liver Fructose-1,6-bisphosphatase Mutant A54L with 1,2-propanediol as Cryo-protectant
分子名称: 6-O-phosphono-beta-D-fructofuranose, ADENOSINE MONOPHOSPHATE, Fructose-1,6-bisphosphatase 1, ...
著者Honzatko, R.B, Gao, Y.
登録日2012-07-28
公開日2013-08-21
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Water Structure of the Central Hydrophobic Cavity of Mammalian Fructose-1,6-bisphosphatase: a Potential Thermodynamic Determinant of Allowed Quaternary States
To be published
4GEG
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BU of 4geg by Molmil
Crystal Structure of E.coli MenH Y85F Mutant
分子名称: 1,2-ETHANEDIOL, 2-succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate synthase, CHLORIDE ION, ...
著者Johnston, J.M, Baker, E.N, Guo, Z, Jiang, M.
登録日2012-08-01
公開日2013-05-08
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.49 Å)
主引用文献Crystal Structures of E. coli Native MenH and Two Active Site Mutants.
Plos One, 8, 2013
3D81
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BU of 3d81 by Molmil
Sir2-S-alkylamidate complex crystal structure
分子名称: NAD-dependent deacetylase, S-alkylamidate intermediate, ZINC ION
著者Hawse, W.F, Hoff, K.G, Fatkins, D, Daines, A, Zubkova, O.V, Schramm, V.L, Zheng, W, Wolberger, C.
登録日2008-05-22
公開日2008-09-30
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structural insights into intermediate steps in the Sir2 deacetylation reaction.
Structure, 16, 2008
3CXM
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BU of 3cxm by Molmil
Leishmania naiffi uracil-DNA glycosylase in complex with 5-bromouracil
分子名称: 5-bromopyrimidine-2,4(1H,3H)-dione, BROMIDE ION, GLYCEROL, ...
著者Larson, E.T, Merritt, E.A, Structural Genomics of Pathogenic Protozoa Consortium (SGPP)
登録日2008-04-24
公開日2008-05-06
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Structures of Leishmania naiffi uracil-DNA glycosylase in complex with several ligands identified with fragment cocktail crystallography.
To be Published
4GH8
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BU of 4gh8 by Molmil
Crystal structure of a 'humanized' E. coli dihydrofolate reductase
分子名称: CALCIUM ION, Dihydrofolate reductase, METHOTREXATE, ...
著者French, J.B, Liu, C.T, Hanoian, P, Pringle, T.H, Hammes-Schiffer, S, Benkovic, S.J.
登録日2012-08-07
公開日2013-06-05
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Functional significance of evolving protein sequence in dihydrofolate reductase from bacteria to humans.
Proc.Natl.Acad.Sci.USA, 110, 2013
4GIQ
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BU of 4giq by Molmil
Crystal Structure of mouse RANK bound to RANKL
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, SODIUM ION, ...
著者Nelson, C.A, Wang, M.W.-H, Fremont, D.H.
登録日2012-08-08
公開日2012-10-24
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献RANKL Employs Distinct Binding Modes to Engage RANK and the Osteoprotegerin Decoy Receptor.
Structure, 20, 2012
4GIV
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BU of 4giv by Molmil
Crystal structure of a SMT fusion Peptidyl-prolyl cis-trans isomerase with surface mutation D44G from Burkholderia pseudomallei complexed with CJ183
分子名称: 3-(pyridin-3-yl)propyl (2S)-1-[(3-nitrophenyl)sulfonyl]piperidine-2-carboxylate, FORMIC ACID, Ubiquitin-like protein SMT3, ...
著者Seattle Structural Genomics Center for Infectious Disease (SSGCID)
登録日2012-08-09
公開日2012-09-05
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.45 Å)
主引用文献A structural biology approach enables the development of antimicrobials targeting bacterial immunophilins.
Antimicrob.Agents Chemother., 58, 2014
4GGQ
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BU of 4ggq by Molmil
Crystal structure of a SMT fusion Peptidyl-prolyl cis-trans isomerase from Burkholderia pseudomallei complexed with CJ40
分子名称: 3-(3,4,5-trimethoxyphenyl)propyl (2S)-1-(benzylsulfonyl)piperidine-2-carboxylate, CALCIUM ION, DI(HYDROXYETHYL)ETHER, ...
著者Seattle Structural Genomics Center for Infectious Disease (SSGCID)
登録日2012-08-07
公開日2012-08-15
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献A structural biology approach enables the development of antimicrobials targeting bacterial immunophilins.
Antimicrob.Agents Chemother., 58, 2014
4GMA
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BU of 4gma by Molmil
Crystal structure of the adenosylcobalamin riboswitch
分子名称: Adenosylcobalamin, Adenosylcobalamin riboswitch
著者Reyes, F.E, Johnson, J.E, Polaski, J.T, Batey, R.T.
登録日2012-08-15
公開日2012-10-17
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (3.94 Å)
主引用文献B12 cofactors directly stabilize an mRNA regulatory switch.
Nature, 492, 2012
4GMM
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BU of 4gmm by Molmil
Structure of rat cytosolic PEPCK Ld_1g in complex with Beta-Sulfopyruvate and GTP
分子名称: GUANOSINE-5'-TRIPHOSPHATE, MANGANESE (II) ION, Phosphoenolpyruvate carboxykinase, ...
著者Johnson, T.A, Holyoak, T.
登録日2012-08-16
公開日2013-07-03
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.736 Å)
主引用文献The {Omega}-loop lid domain of phosphoenolpyruvate carboxykinase is essential for catalytic function.
Biochemistry, 51, 2012
4GMW
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BU of 4gmw by Molmil
Structure of rat cytosolic PEPCK Ld_1g in complex with PEP and GDP
分子名称: GUANOSINE-5'-DIPHOSPHATE, MANGANESE (II) ION, PHOSPHOENOLPYRUVATE, ...
著者Johnson, T.A, Holyoak, T.
登録日2012-08-16
公開日2013-07-03
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献The {Omega}-loop lid domain of phosphoenolpyruvate carboxykinase is essential for catalytic function.
Biochemistry, 51, 2012
3CFN
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BU of 3cfn by Molmil
Crystal structure of human transthyretin in complex with 1-anilino-8-naphthalene sulfonate
分子名称: 8-ANILINO-1-NAPHTHALENE SULFONATE, Transthyretin
著者Lima, L.-M.T.R, Foguel, D, Polikarpov, I.
登録日2008-03-04
公開日2009-03-03
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.87 Å)
主引用文献Identification of a novel ligand binding motif in the transthyretin channel.
Bioorg.Med.Chem., 18, 2010
4GJY
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BU of 4gjy by Molmil
JMJD5 in complex with N-Oxalylglycine
分子名称: COBALT (II) ION, JmjC domain-containing protein 5, N-OXALYLGLYCINE
著者Del Rizzo, P.A, Trievel, R.C.
登録日2012-08-10
公開日2012-09-05
最終更新日2012-11-14
実験手法X-RAY DIFFRACTION (1.2492 Å)
主引用文献Crystal Structure and Functional Analysis of JMJD5 Indicate an Alternate Specificity and Function.
Mol.Cell.Biol., 32, 2012
4GK9
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BU of 4gk9 by Molmil
Crystal structure of Burkholderia oklahomensis agglutinin (BOA) bound to 3a,6a-mannopentaose
分子名称: IMIDAZOLE, SODIUM ION, agglutinin (BOA), ...
著者Whitley, M.J, Furey, W, Gronenborn, A.M.
登録日2012-08-10
公開日2013-05-08
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Burkholderia oklahomensis agglutinin is a canonical two-domain OAA-family lectin: structures, carbohydrate binding and anti-HIV activity.
Febs J., 280, 2013
4GM2
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BU of 4gm2 by Molmil
The crystal structure of a peptidase from plasmodium falciparum
分子名称: ATP-dependent Clp protease proteolytic subunit
著者El Bakkouri, M, Jung, P, Wernimont, A.K, Calmettes, C, Hui, R, Houry, W.A, Structural Genomics Consortium (SGC)
登録日2012-08-15
公開日2012-12-05
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Structural Insights into the Inactive Subunit of the Apicoplast-localized Caseinolytic Protease Complex of Plasmodium falciparum.
J.Biol.Chem., 288, 2013
4FG0
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BU of 4fg0 by Molmil
Structure of the St. Louis Encephalitis Virus envelope protein in the fusogenic trimer conformation.
分子名称: Polyprotein
著者Luca, V.C, Nelson, C.A, Fremont, D.H, Center for Structural Genomics of Infectious Diseases (CSGID)
登録日2012-06-01
公開日2012-06-27
最終更新日2017-11-15
実験手法X-RAY DIFFRACTION (3.899 Å)
主引用文献Structure of the st. Louis encephalitis virus postfusion envelope trimer.
J.Virol., 87, 2013
4FG3
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BU of 4fg3 by Molmil
Crystal Structure Analysis of the Human Insulin
分子名称: CHLORIDE ION, GLYCEROL, Insulin, ...
著者Lima, L.M.T.R, Favero-Retto, M.P.
登録日2012-06-02
公開日2013-06-12
最終更新日2017-11-15
実験手法X-RAY DIFFRACTION (2.001 Å)
主引用文献Structural meta-analysis of regular human insulin in pharmaceutical formulations.
Eur J Pharm Biopharm, 85, 2013

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