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3V16
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An intramolecular pi-cation latch in phosphatidylinositol-specific phospholipase C from S.aureus controls substrate access to the active site
分子名称: 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE, 1-phosphatidylinositol phosphodiesterase, CHLORIDE ION
著者Goldstein, R.I, Cheng, J, Stec, B, Roberts, M.F.
登録日2011-12-09
公開日2012-04-04
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Structure of the S. aureus PI-Specific Phospholipase C Reveals Modulation of Active Site Access by a Titratable PI-Cation Latched Loop
Biochemistry, 51, 2012
4OA7
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Crystal structure of Tankyrase1 in complex with IWR1
分子名称: 4-[(3aR,4R,7S,7aS)-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]-N-(quinolin-8-yl)benzamide, Tankyrase-1, ZINC ION
著者Zhang, X, He, H.
登録日2014-01-03
公開日2015-01-07
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.301 Å)
主引用文献Disruption of Wnt/ beta-Catenin Signaling and Telomeric Shortening Are Inextricable Consequences of Tankyrase Inhibition in Human Cells.
Mol.Cell.Biol., 35, 2015
2RAH
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Human FDPS synthase in complex with novel inhibitor
分子名称: Farnesyl pyrophosphate synthetase, MAGNESIUM ION, SULFATE ION, ...
著者Evdokimov, A.G, Barnett, B.L, Ebetino, F.H, Pokross, M.
登録日2007-09-15
公開日2007-09-25
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Human FDPS synthase in complex with novel inhibitor
To be Published
4OAQ
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BU of 4oaq by Molmil
Crystal structure of the R-specific Carbonyl Reductase from Candida parapsilosis ATCC 7330
分子名称: 2,3-DIHYDROXY-1,4-DITHIOBUTANE, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, GLYCEROL, ...
著者Aggrawal, N, Mandal, P.K, Gautham, N, Chadha, A.
登録日2014-01-06
公開日2015-02-11
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.858 Å)
主引用文献Insights into the stereoselectivity of R-specific Carbonyl Reductase from Candida parapsilosis ATCC 7330: Biochemical Characterization and Crystal structure studies
To be Published
4OLM
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BU of 4olm by Molmil
Crystal structure of W741L-AR-LBD bound with co-regulator peptide
分子名称: Androgen receptor, R-BICALUTAMIDE, co-regulator peptide
著者Liu, J.S, Hsu, C.L, Wu, W.G.
登録日2014-01-24
公開日2014-08-20
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Identification of a new androgen receptor (AR) co-regulator BUD31 and related peptides to suppress wild-type and mutated AR-mediated prostate cancer growth via peptide screening and X-ray structure analysis.
Mol Oncol, 8, 2014
3V18
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BU of 3v18 by Molmil
Structure of the Phosphatidylinositol-specific phospholipase C from Staphylococcus aureus
分子名称: 1-phosphatidylinositol phosphodiesterase, ISOPROPYL ALCOHOL, SULFATE ION
著者Goldstein, R.I, Cheng, J, Stec, B, Roberts, M.F.
登録日2011-12-09
公開日2012-04-04
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.34 Å)
主引用文献Structure of the S. aureus PI-Specific Phospholipase C Reveals Modulation of Active Site Access by a Titratable PI-Cation Latched Loop
Biochemistry, 51, 2012
2RFZ
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BU of 2rfz by Molmil
Crystal structure of cellobiohydrolase from Melanocarpus albomyces complexed with cellotriose
分子名称: Cellulose 1,4-beta-cellobiosidase, beta-D-glucopyranose-(1-4)-beta-D-glucopyranose-(1-4)-alpha-D-glucopyranose
著者Parkkinen, T, Koivula, A, Vehmaanper, J, Rouvinen, J.
登録日2007-10-02
公開日2008-09-16
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal structures of Melanocarpus albomyces cellobiohydrolase Cel7B in complex with cello-oligomers show high flexibility in the substrate binding
Protein Sci., 17, 2008
4OB3
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BU of 4ob3 by Molmil
Crystal Structure of Nitrile Hydratase from Pseudonocardia thermophila : A Reference Structure to Boronic Acid Inhibition of Nitrile Hydratase
分子名称: COBALT (II) ION, Cobalt-containing nitrile hydratase subunit alpha, Cobalt-containing nitrile hydratase subunit beta, ...
著者Rui, W, Salette, M, Ruslan, S, Richard, H, Dali, L.
登録日2014-01-06
公開日2014-11-26
最終更新日2019-11-20
実験手法X-RAY DIFFRACTION (1.92 Å)
主引用文献The active site sulfenic acid ligand in nitrile hydratases can function as a nucleophile.
J.Am.Chem.Soc., 136, 2014
3V14
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Crystal structure of the complex of type I Ribosome inactivating protein complexed with Trehalose at 1.70 A resolution
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, GLYCEROL, Ribosome inactivating protein, ...
著者Yamini, S, Pandey, S, Kushwaha, G.S, Sinha, M, Kaur, P, Sharma, S, Singh, T.P.
登録日2011-12-09
公開日2012-01-04
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Crystal structure of the complex of type I Ribosome inactivating protein complexed with Trehalose at 1.70 A resolution
To be Published
2RGZ
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BU of 2rgz by Molmil
Ensemble refinement of the protein crystal structure of human heme oxygenase-2 C127A (HO-2) with bound heme
分子名称: Heme oxygenase 2, PROTOPORPHYRIN IX CONTAINING FE
著者Bianchetti, C.M, Bingman, C.A, Bitto, E, Wesenberg, G.E, Phillips Jr, G.N, Center for Eukaryotic Structural Genomics (CESG)
登録日2007-10-05
公開日2007-10-23
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.61 Å)
主引用文献Comparison of Apo- and Heme-bound Crystal Structures of a Truncated Human Heme Oxygenase-2.
J.Biol.Chem., 282, 2007
3V1A
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BU of 3v1a by Molmil
Crystal structure of de novo designed MID1-apo1
分子名称: Computational design, MID1-apo1
著者Der, B.S, Machius, M, Miley, M.J, Kuhlman, B.
登録日2011-12-09
公開日2012-01-11
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (0.98 Å)
主引用文献Metal-mediated affinity and orientation specificity in a computationally designed protein homodimer.
J.Am.Chem.Soc., 134, 2012
4G2P
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BU of 4g2p by Molmil
Crystal structure of peptidyl-prolyl cis-trans isomerase domain II of molecular chaperone SurA from Salmonella enterica subsp. enterica serovar Typhimurium str. 14028S
分子名称: Chaperone SurA, GLYCEROL, SULFATE ION
著者Chang, C, Wu, R, Adkins, J.N, Brown, R.N, Cort, J.R, Heffron, F, Nakayasu, E.S, Jedrzejczak, R, Joachimiak, A, Midwest Center for Structural Genomics (MCSG), Program for the Characterization of Secreted Effector Proteins (PCSEP)
登録日2012-07-12
公開日2012-08-01
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (1.82 Å)
主引用文献Crystal structure of peptidyl-prolyl cis-trans isomerase domain II of molecular chaperone SurA from Salmonella enterica subsp. enterica serovar Typhimurium str. 14028S
TO BE PUBLISHED
3V1Y
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BU of 3v1y by Molmil
Crystal structures of glyceraldehyde-3-phosphate dehydrogenase complexes with NAD
分子名称: Glyceraldehyde-3-phosphate dehydrogenase, cytosolic, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
著者Tien, Y.C, Chuankhayan, P, Lin, Y.H, Chang, S.L, Chen, C.J.
登録日2011-12-10
公開日2012-11-28
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (1.86 Å)
主引用文献Crystal structures of rice (Oryza sativa) glyceraldehyde-3-phosphate dehydrogenase complexes with NAD and sulfate suggest involvement of Phe37 in NAD binding for catalysis
Plant Mol.Biol., 80, 2012
4OM7
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BU of 4om7 by Molmil
Crystal structure of TIR domain of TLR6
分子名称: Toll-like receptor 6
著者Park, H.H, Jang, T.H.
登録日2014-01-26
公開日2014-08-06
最終更新日2018-01-24
実験手法X-RAY DIFFRACTION (2.204 Å)
主引用文献Crystal Structure of TIR Domain of TLR6 Reveals Novel Dimeric Interface of TIR-TIR Interaction for Toll-Like Receptor Signaling Pathway.
J.Mol.Biol., 426, 2014
3V1E
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BU of 3v1e by Molmil
Crystal structure of de novo designed MID1-zinc H12E mutant
分子名称: Computational design, MID1-zinc H12E mutant, ZINC ION
著者Der, B.S, Machius, M, Miley, M.J, Kuhlman, B.
登録日2011-12-09
公開日2012-01-11
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.073 Å)
主引用文献Metal-mediated affinity and orientation specificity in a computationally designed protein homodimer.
J.Am.Chem.Soc., 134, 2012
4OMA
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BU of 4oma by Molmil
The crystal structure of methionine gamma-lyase from Citrobacter freundii in complex with L-cycloserine pyridoxal-5'-phosphate
分子名称: CHLORIDE ION, DI(HYDROXYETHYL)ETHER, TRIETHYLENE GLYCOL, ...
著者Revtovich, S.V, Nikulin, A.D, Morozova, E.A, Demidkina, T.V.
登録日2014-01-27
公開日2014-11-26
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Pre-steady-state Kinetic and Structural Analysis of Interaction of Methionine gamma-Lyase from Citrobacter freundii with Inhibitors.
J.Biol.Chem., 290, 2015
4OC0
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BU of 4oc0 by Molmil
X-ray structure of of human glutamate carboxypeptidase II (GCPII) in a complex with CCIBzL, a urea-based inhibitor N~2~-[(1-carboxycyclopropyl)carbamoyl]-N~6~-(4-iodobenzoyl)-L-lysine
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, ...
著者Pavlicek, J, Ptacek, J, Cerny, J, Byun, Y, Skultetyova, L, Pomper, M, Lubkowski, J, Barinka, C.
登録日2014-01-08
公開日2014-05-21
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Structural characterization of P1'-diversified urea-based inhibitors of glutamate carboxypeptidase II.
Bioorg.Med.Chem.Lett., 24, 2014
3V1O
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BU of 3v1o by Molmil
Crystal structures of the reverse transcriptase-associated ribonuclease H domain of xenotropic murine leukemia-virus related virus
分子名称: (4R)-2-METHYLPENTANE-2,4-DIOL, GLYCEROL, Reverse transcriptase/ribonuclease H p80, ...
著者Zhou, D, Wlodawer, A.
登録日2011-12-09
公開日2012-03-14
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.876 Å)
主引用文献Crystal structures of the reverse transcriptase-associated ribonuclease H domain of xenotropic murine leukemia-virus related virus.
J.Struct.Biol., 177, 2012
4OCQ
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BU of 4ocq by Molmil
N-acetylhexosamine 1-phosphate kinase in complex with GalNAc
分子名称: 2-acetamido-2-deoxy-alpha-D-galactopyranose, N-acetylhexosamine 1-phosphate kinase
著者Li, T.L, Wang, K.C, Lyu, S.Y, Liu, Y.C, Chang, C.Y, Wu, C.J.
登録日2014-01-09
公開日2014-05-14
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.878 Å)
主引用文献Insights into the binding specificity and catalytic mechanism of N-acetylhexosamine 1-phosphate kinases through multiple reaction complexes.
Acta Crystallogr.,Sect.D, 70, 2014
3V2U
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BU of 3v2u by Molmil
Crystal structure of the yeast GAL regulon complex of the repressor, Gal80p, and the transducer, Gal3p, with galactose and ATP
分子名称: ADENOSINE-5'-TRIPHOSPHATE, GLYCEROL, Galactose/lactose metabolism regulatory protein GAL80, ...
著者Lavy, T, Kumar, P.R, He, H, Joshua-Tor, L.
登録日2011-12-12
公開日2012-02-08
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.105 Å)
主引用文献The Gal3p transducer of the GAL regulon interacts with the Gal80p repressor in its ligand-induced closed conformation.
Genes Dev., 26, 2012
3V1V
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BU of 3v1v by Molmil
Crystal structure of 2-methylisoborneol synthase from Streptomyces coelicolor A3(2) in complex with Mg2+ and geranyl-S-thiolodiphosphate
分子名称: 2-methylisoborneol synthase, GERANYL S-THIOLODIPHOSPHATE, GLYCEROL, ...
著者Koksal, M, Christianson, D.W.
登録日2011-12-10
公開日2012-04-11
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structure of 2-Methylisoborneol Synthase from Streptomyces coelicolor and Implications for the Cyclization of a Noncanonical C-Methylated Monoterpenoid Substrate.
Biochemistry, 51, 2012
4OD6
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Structure of Smr domain of MutS2 from Deinococcus radiodurans, Mn2+ soaked
分子名称: Endonuclease MutS2
著者Zhang, H, Zhao, Y, Xu, Q, Hua, Y.J.
登録日2014-01-10
公開日2014-06-25
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.199 Å)
主引用文献Structural and functional studies of MutS2 from Deinococcus radiodurans.
Dna Repair, 21, 2014
3V2G
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Crystal structure of a dehydrogenase/reductase from Sinorhizobium meliloti 1021
分子名称: 3-oxoacyl-[acyl-carrier-protein] reductase, SULFATE ION
著者Agarwal, R, Chamala, S, Evans, B, Foti, R, Gizzi, A, Hillerich, B, Kar, A, LaFleur, J, Seidel, R, Villigas, G, Zencheck, W, Almo, S.C, Swaminathan, S, New York Structural Genomics Research Consortium (NYSGRC)
登録日2011-12-12
公開日2012-01-04
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Crystal structure of a dehydrogenase/reductase from Sinorhizobium meliloti 1021
To be Published
4OMW
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Crystal structure of goat beta-lactoglobulin (orthorhombic form)
分子名称: Beta-lactoglobulin, GLYCEROL, SULFATE ION, ...
著者Loch, J.I, Swiatek, S, Czub, M, Ludwikowska, M, Lewinski, K.
登録日2014-01-27
公開日2014-11-19
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Conformational variability of goat beta-lactoglobulin: Crystallographic and thermodynamic studies.
Int.J.Biol.Macromol., 72C, 2014
4G4X
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Crystal structure of peptidoglycan-associated lipoprotein from Acinetobacter baumannii
分子名称: D-ALANINE, GLYCEROL, Peptidoglycan-associated lipoprotein, ...
著者Lee, W.C, Song, J.H, Park, J.S, Kim, H.Y.
登録日2012-07-16
公開日2013-07-24
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Enantiomer-dependent amino acid binding affinity of OmpA-like domains from Acinetobacter baumannii peptidoglycan-associated lipoprotein and OmpA
To be Published

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件を2024-08-21に公開中

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