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6QCX
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Crystal structure of influenza B polymerase initiation state with capped 15-mer RNA primer
分子名称: MAGNESIUM ION, PHOSPHATE ION, PYROPHOSPHATE 2-, ...
著者Cusack, S, Drncova, P.
登録日2018-12-31
公開日2019-06-05
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (3.08 Å)
主引用文献Structural snapshots of actively transcribing influenza polymerase.
Nat.Struct.Mol.Biol., 26, 2019
6TN9
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BU of 6tn9 by Molmil
X-RAY STRUCTURE OF MPS1 IN COMPLEX WITH COMPOUND 16
分子名称: Dual specificity protein kinase TTK, [4-[[6-(3,5-dimethyl-4-oxidanyl-phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-morpholin-4-yl-methanone
著者Marquardt, T, Holton, S.J, Schulze, V.K, Klar, U, Kosemund, D, Siemeister, G, Bader, B, Prechtl, S, Briem, H, Schirok, H, Bohlmann, R, Nguyen, D, Fernandez-Montalvan, A, Boemer, U, Eberspaecher, U, Brands, M, Nussbaum, F, Koppitz, M.
登録日2019-12-06
公開日2020-05-13
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Treating Cancer by Spindle Assembly Checkpoint Abrogation: Discovery of Two Clinical Candidates, BAY 1161909 and BAY 1217389, Targeting MPS1 Kinase.
J.Med.Chem., 63, 2020
4II8
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Lysozyme with Benzyl alcohol
分子名称: CHLORIDE ION, GLYCEROL, Lysozyme C, ...
著者Sharma, P, Ashish
登録日2012-12-20
公開日2013-12-25
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.88 Å)
主引用文献Characterization of heat induced spherulites of lysozyme reveals new insight on amyloid initiation
Sci Rep, 6, 2016
6TP9
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c-type cytochrome NirC
分子名称: Cytochrome c55X, HEME C
著者Kluenemann, T, Henke, S, Blankenfeldt, W.
登録日2019-12-12
公開日2020-04-22
実験手法X-RAY DIFFRACTION (2.19 Å)
主引用文献The crystal structure of the heme d1biosynthesis-associated small c-type cytochrome NirC reveals mixed oligomeric states in crystallo.
Acta Crystallogr D Struct Biol, 76, 2020
4JZB
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BU of 4jzb by Molmil
Crystal Structure of Leshmaniasis major Farnesyl diphosphate synthase in complex with 1-(2-HYDROXY-2,2-DIPHOSPHONOETHYL)-3-PHENYLPYRIDINIUM, IPP and Ca2+
分子名称: 1-(2-hydroxy-2,2-diphosphonoethyl)-3-phenylpyridinium, 3-METHYLBUT-3-ENYL TRIHYDROGEN DIPHOSPHATE, CALCIUM ION, ...
著者Aripirala, S, Amzel, L.M, Gabelli, S.
登録日2013-04-02
公開日2014-02-12
最終更新日2017-11-15
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structural and thermodynamic basis of the inhibition of Leishmania major farnesyl diphosphate synthase by nitrogen-containing bisphosphonates.
Acta Crystallogr.,Sect.D, 70, 2014
6PXV
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BU of 6pxv by Molmil
Cryo-EM structure of full-length insulin receptor bound to 4 insulin. 3D refinement was focused on the extracellular region.
分子名称: Insulin, Insulin receptor
著者Uchikawa, E, Choi, E, Shang, G.J, Yu, H.T, Bai, X.C.
登録日2019-07-27
公開日2019-09-04
実験手法ELECTRON MICROSCOPY (3.2 Å)
主引用文献Activation mechanism of the insulin receptor revealed by cryo-EM structure of the fully liganded receptor-ligand complex.
Elife, 8, 2019
6Q03
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BU of 6q03 by Molmil
Crystal structure of MurA from Clostridium difficile in the presence of UDP-N-acetyl-alpha-D-muramic acid with modified Cys116 (S-[(1S)-1-carboxy-1-(phosphonooxy)ethyl]-L-cysteine)
分子名称: (2R)-2-{[(2R,3R,4R,5S,6R)-3-(acetylamino)-2-{[(S)-{[(R)-{[(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}-5-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl]oxy}propanoic acid, 1,2-ETHANEDIOL, UDP-N-acetylglucosamine 1-carboxyvinyltransferase
著者Dopkins, B.J, Call, C.J, Thoden, J.B, Holden, H.M.
登録日2019-08-01
公開日2019-11-27
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Crystal structure of MurA from Clostridium difficile in the presence of UDP-N-acetyl-alpha-D-muramic acid with modified Cys116 (S-[(1S)-1-carboxy-1-(phosphonooxy)ethyl]-L-cysteine)
To Be Published
4J1B
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BU of 4j1b by Molmil
X-ray structure of the adduct between hen egg white lysozyme and AziRu (black crystal)
分子名称: CHLORIDE ION, Lysozyme C, RUTHENIUM ION, ...
著者Vergara, A, Merlino, A.
登録日2013-02-01
公開日2013-04-03
最終更新日2013-05-08
実験手法X-RAY DIFFRACTION (1.66 Å)
主引用文献Interaction of Anticancer Ruthenium Compounds with Proteins: High-Resolution X-ray Structures and Raman Microscopy Studies of the Adduct between Hen Egg White Lysozyme and AziRu.
Inorg.Chem., 52, 2013
3I2C
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BU of 3i2c by Molmil
Crystal structure of anti-IL-23 antibody CNTO4088
分子名称: CNTO4088 HEAVY CHAIN, CNTO4088 LIGHT CHAIN, GLYCEROL
著者Teplyakov, A, Obmolova, G, Gilliland, G.L.
登録日2009-06-29
公開日2009-07-07
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Noncanonical conformation of CDR L1 in the anti-IL-23 antibody CNTO4088.
Acta Crystallogr.,Sect.F, 66, 2010
3CZV
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BU of 3czv by Molmil
Crystal structure of the human carbonic anhydrase XIII in complex with acetazolamide
分子名称: 5-ACETAMIDO-1,3,4-THIADIAZOLE-2-SULFONAMIDE, Carbonic anhydrase 13, GLYCEROL, ...
著者Di Fiore, A, De Simone, G.
登録日2008-04-30
公開日2008-07-29
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Crystal structure of human carbonic anhydrase XIII and its complex with the inhibitor acetazolamide.
Proteins, 74, 2008
6PT4
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BU of 6pt4 by Molmil
Crystal structure of apo PsS1_NC
分子名称: 1,2-ETHANEDIOL, CALCIUM ION, CHLORIDE ION, ...
著者Hettle, A.G, Boraston, A.B.
登録日2019-07-14
公開日2019-09-25
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献Insights into the kappa / iota-carrageenan metabolism pathway of some marinePseudoalteromonasspecies.
Commun Biol, 2, 2019
3I4C
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BU of 3i4c by Molmil
Crystal structure of Sulfolobus Solfataricus ADH(SsADH) double mutant (W95L,N249Y)
分子名称: NAD-dependent alcohol dehydrogenase, ZINC ION
著者Esposito, L, Pennacchio, A, Zagari, A, Rossi, M, Raia, C.A.
登録日2009-07-01
公開日2009-07-21
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Role of Tryptophan 95 in substrate specificity and structural stability of Sulfolobus solfataricus alcohol dehydrogenase
Extremophiles, 13, 2009
4ISA
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BU of 4isa by Molmil
Crystal Structure of the Escherichia coli LpxC/BB-78485 complex
分子名称: (2R)-N-hydroxy-3-naphthalen-2-yl-2-[(naphthalen-2-ylsulfonyl)amino]propanamide, (4S,5S)-1,2-DITHIANE-4,5-DIOL, FORMIC ACID, ...
著者Lee, C.-J, Zhou, P.
登録日2013-01-16
公開日2013-10-30
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structural Basis of the Promiscuous Inhibitor Susceptibility of Escherichia coli LpxC.
Acs Chem.Biol., 9, 2014
3HOG
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BU of 3hog by Molmil
Metal-free Tomato Chloroplast Superoxide Dismutase
分子名称: POTASSIUM ION, Superoxide dismutase [Cu-Zn], chloroplastic
著者Galaleldeen, A, Taylor, A.B, Hart, P.J.
登録日2009-06-02
公開日2010-06-23
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Biophysical Properties of Tomato Chloroplast SOD
To be Published
6VVA
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BU of 6vva by Molmil
N-Acetylmannosamine-6-phosphate 2-epimerase from Staphylococcus aureus (strain MRSA USA300)
分子名称: CHLORIDE ION, CITRIC ACID, N-acetylmannosamine-6-phosphate 2-epimerase
著者Renwick, R.C.J, Currie, M.J.
登録日2020-02-17
公開日2021-02-24
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.84 Å)
主引用文献N-acetylmannosamine-6-phosphate 2-epimerase uses a novel substrate-assisted mechanism to catalyze amino sugar epimerization.
J.Biol.Chem., 297, 2021
4DDL
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BU of 4ddl by Molmil
PDE10a Crystal Structure Complexed with Novel Inhibitor
分子名称: 2-{1-[5-(6,7-dimethoxycinnolin-4-yl)-3-methylpyridin-2-yl]piperidin-4-yl}propan-2-ol, SULFATE ION, ZINC ION, ...
著者Chmait, S, Jordan, S, Zhang, J.
登録日2012-01-18
公開日2012-03-21
実験手法X-RAY DIFFRACTION (2.07 Å)
主引用文献Discovery of potent, selective, and metabolically stable 4-(pyridin-3-yl)cinnolines as novel phosphodiesterase 10A (PDE10A) inhibitors.
Bioorg.Med.Chem.Lett., 22, 2012
4DEH
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BU of 4deh by Molmil
Crystal structure of c-Met in complex with triazolopyridinone inhibitor 3
分子名称: 5-phenyl-3-(quinolin-6-ylmethyl)-3,5,6,7-tetrahydro-4H-[1,2,3]triazolo[4,5-c]pyridin-4-one, Hepatocyte growth factor receptor
著者Whittington, D.A, Bellon, S.F, Long, A.M.
登録日2012-01-20
公開日2012-05-30
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Discovery and optimization of a potent and selective triazolopyridinone series of c-Met inhibitors.
Bioorg.Med.Chem.Lett., 22, 2012
6Q10
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BU of 6q10 by Molmil
Crystal structure of the soluble domain (residues 71-217) of a conserved hypothetical secreted protein (Rv2700 ortholog) from Mycobacterium marinum
分子名称: 1,2-ETHANEDIOL, MymaA.19257.a.B3
著者Seattle Structural Genomics Center for Infectious Disease (SSGCID)
登録日2019-08-02
公開日2019-08-14
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献SSGCID, Mycobacerium marinum, Structural Genomics, Seattle Structural Genomics Center for Infectious Disease, secreted protein, Rv2700 ortholog
to be published
6RCQ
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BU of 6rcq by Molmil
PfRH5-binding monoclonal antibody R5.011
分子名称: ACETATE ION, CACODYLATE ION, R5.011 heavy chain, ...
著者Alanine, D.W.G, Draper, S.J, Higgins, M.K.
登録日2019-04-11
公開日2019-06-26
最終更新日2019-07-10
実験手法X-RAY DIFFRACTION (2.28 Å)
主引用文献Human Antibodies that Slow Erythrocyte Invasion Potentiate Malaria-Neutralizing Antibodies.
Cell, 178, 2019
6RCS
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BU of 6rcs by Molmil
PfRH5-binding monoclonal antibody R5.016
分子名称: ACETATE ION, R5.016 heavy chain, R5.016 light chain, ...
著者Alanine, D.W.G, Jamwal, A, Draper, S.J, Higgins, M.K.
登録日2019-04-11
公開日2019-06-26
最終更新日2019-08-21
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Human Antibodies that Slow Erythrocyte Invasion Potentiate Malaria-Neutralizing Antibodies.
Cell, 178, 2019
3HR9
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BU of 3hr9 by Molmil
The truncated Fibrobacter succinogenes 1,3-1,4-beta-D-glucanase F40I mutant
分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, ACETATE ION, Beta-glucanase, ...
著者Tsai, L.C, Huang, H.C, Hsiao, C.H.
登録日2009-06-09
公開日2009-07-07
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献The truncated Fibrobacter succinogenes 1,3-1,4-beta-D-glucanase mutant F40I
To be Published
4IRP
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BU of 4irp by Molmil
Crystal structure of catalytic domain of human beta1,4-galactosyltransferase-7 in open conformation with manganses and UDP
分子名称: ACETATE ION, Beta-1,4-galactosyltransferase 7, IMIDAZOLE, ...
著者Tsutsui, Y, Ramakrishnan, B, Qasba, P.K.
登録日2013-01-15
公開日2013-09-25
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Crystal Structures of beta-1,4-Galactosyltransferase 7 Enzyme Reveal Conformational Changes and Substrate Binding.
J.Biol.Chem., 288, 2013
4IRO
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BU of 4iro by Molmil
Crystal structure of T-state carbonmonoxy hemoglobin from Trematomus bernacchii at pH 8.4
分子名称: CARBON MONOXIDE, Hemoglobin subunit alpha, Hemoglobin subunit beta, ...
著者Merlino, A, Balsamo, A, Mazzarella, L, Vergara, A.
登録日2013-01-15
公開日2013-02-20
最終更新日2013-10-23
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Role of tertiary structures on the Root effect in fish hemoglobins.
Biochim.Biophys.Acta, 1834, 2013
4ITZ
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BU of 4itz by Molmil
Crystal structure of the FK506 binding domain of Plasmodium vivax FKBP35 in complex with a tetrapeptide substrate
分子名称: 70 kDa peptidylprolyl isomerase, SULFATE ION, substrate peptide
著者Sreekanth, R, Yoon, H.S.
登録日2013-01-19
公開日2013-03-20
最終更新日2013-05-22
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Structural insights into substrate binding by PvFKBP35, a peptidylprolyl cis-trans isomerase from the human malarial parasite Plasmodium vivax.
Eukaryot Cell, 12, 2013
6QCJ
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Human Sirt6 in complex with ADP-ribose and the inhibitor catechin gallate
分子名称: (2R,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl 3,4,5-trihydroxybenzoate, 1,2-ETHANEDIOL, NAD-dependent protein deacetylase sirtuin-6, ...
著者You, W, Steegborn, C.
登録日2018-12-28
公開日2019-12-25
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.01 Å)
主引用文献Structural basis for the activation and inhibition of Sirtuin 6 by quercetin and its derivatives.
Sci Rep, 9, 2019

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