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PDB: 6669 件

2R4F
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Substituted Pyrazoles as Hepatselective HMG-COA reductase inhibitors
分子名称: (3R,5R)-7-[1-(4-fluorophenyl)-4-(1-methylethyl)-3-{methyl[(1R)-1-phenylethyl]carbamoyl}-1H-pyrazol-5-yl]-3,5-dihydroxyheptanoic acid, 3-hydroxy-3-methylglutaryl-coenzyme A reductase, SULFATE ION
著者Pavlovsky, A, Pfefferkorn, J.A, Harris, M.S, Finzel, B.C.
登録日2007-08-31
公開日2008-04-29
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Substituted pyrazoles as hepatoselective HMG-CoA reductase inhibitors: discovery of (3R,5R)-7-[2-(4-fluoro-phenyl)-4-isopropyl-5-(4-methyl-benzylcarbamoyl)-2H-pyrazol-3-yl]-3,5-dihydroxyheptanoic acid (PF-3052334) as a candidate for the treatment of hypercholesterolemia.
J.Med.Chem., 51, 2008
1QMV
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thioredoxin peroxidase B from red blood cells
分子名称: PEROXIREDOXIN-2
著者Isupov, M.N, Littlechild, J.A, Lebedev, A.A, Errington, N, Vagin, A.A, Schroder, E.
登録日1999-10-07
公開日2000-07-28
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Crystal Structure of Decameric 2-Cys Peroxiredoxin from Human Erythrocytes at 1.7 A Resolution.
Structure, 8, 2000
7QEK
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Structure of the ligand binding domain of the antibiotic biosynthesis regulator AdmX from the rhizobacterium Serratia plymuthica A153 bound to the auxin indole-3-piruvic acid (IPA).
分子名称: 3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACID, MAGNESIUM ION, regulator AdmX
著者Gavira, J.A, Rico-Jimenez, M, Castellvi, A, Krell, T, Matilla, M.A.
登録日2021-12-03
公開日2022-12-14
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Emergence of an Auxin Sensing Domain in Plant-Associated Bacteria.
Mbio, 14, 2023
7QEJ
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Structure of the ligand binding domain of the antibiotic biosynthesis regulator AdmX from the rhizobacterium Serratia plymuthica A153 bound to the auxin indole-3-acetic acid (IAA).
分子名称: 1H-INDOL-3-YLACETIC ACID, MAGNESIUM ION, TRANSCRIPTIONAL REGULATOR AdmX
著者Gavira, J.A, Rico-Jimenez, M, Castellvi, A, Krell, T, Matilla, M.A.
登録日2021-12-03
公開日2022-12-14
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.81 Å)
主引用文献Emergence of an Auxin Sensing Domain in Plant-Associated Bacteria.
Mbio, 14, 2023
192D
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BU of 192d by Molmil
RECOMBINATION-LIKE STRUCTURE OF D(CCGCGG)
分子名称: DNA (5'-D(*CP*CP*GP*CP*GP*G)-3'), SODIUM ION
著者Malinina, L, Urpi, L, Salas, X, Huynh-Dinh, T, Subirana, J.A.
登録日1994-09-22
公開日1995-02-07
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.92 Å)
主引用文献Recombination-like structure of d(CCGCGG).
J.Mol.Biol., 243, 1994
7QTR
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GB1 in mammalian cells, 50 uM
分子名称: Immunoglobulin G-binding protein G
著者Gerez, J.A, Prymaczok, N.C, Kadavath, H, Gosh, D, Butikofer, M, Guntert, P, Riek, R.
登録日2022-01-15
公開日2022-12-21
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献Protein structure determination in human cells by in-cell NMR and a reporter system to optimize protein delivery or transexpression.
Commun Biol, 5, 2022
7QTS
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GB1 in mammalian cells, 10 uM
分子名称: Immunoglobulin G-binding protein G
著者Gerez, J.A, Prymaczok, N.C, Kadavath, H, Gosh, D, Butikofer, M, Guntert, P, Riek, R.
登録日2022-01-15
公開日2022-12-21
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献Protein structure determination in human cells by in-cell NMR and a reporter system to optimize protein delivery or transexpression.
Commun Biol, 5, 2022
6VBH
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Human XPG endonuclease catalytic domain
分子名称: DNA repair protein complementing XP-G cells,Flap endonuclease 1, SULFATE ION
著者Tsutakawa, S.E, Arvai, A.S, Tainer, J.A.
登録日2019-12-18
公開日2020-06-17
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.995 Å)
主引用文献Human XPG nuclease structure, assembly, and activities with insights for neurodegeneration and cancer from pathogenic mutations.
Proc.Natl.Acad.Sci.USA, 117, 2020
2QH6
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Crystal Structure of the Estrogen Receptor Alpha Ligand Binding Domain Complexed with an Oxabicyclic diarylethylene Compound
分子名称: DIETHYL (1R,2S,3R,4S)-5,6-BIS(4-HYDROXYPHENYL)-7-OXABICYCLO[2.2.1]HEPT-5-ENE-2,3-DICARBOXYLATE, Estrogen receptor, Nuclear receptor coactivator 2
著者Nettles, K.W, Bruning, J.B, Nowak, J, Sharma, S.K, Hahm, J.B, Shi, Y, Kulp, K, Hochberg, R.B, Zhou, H, Katzenellenbogen, J.A, Katzenellenbogen, B.S, Kim, Y, Joachmiak, A, Greene, G.L.
登録日2007-06-29
公開日2008-03-18
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献NFkappaB selectivity of estrogen receptor ligands revealed by comparative crystallographic analyses
Nat.Chem.Biol., 4, 2008
1QLW
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The Atomic Resolution Structure of a Novel Bacterial Esterase
分子名称: ESTERASE, SULFATE ION
著者Bourne, P.C, Isupov, M.N, Littlechild, J.A.
登録日1999-09-17
公開日2000-02-10
最終更新日2024-10-09
実験手法X-RAY DIFFRACTION (1.09 Å)
主引用文献The Atomic Resolution Structure of a Novel Bacterial Esterase
Structure, 8, 2000
2QJJ
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Crystal structure of D-Mannonate dehydratase from Novosphingobium aromaticivorans
分子名称: MAGNESIUM ION, Mandelate racemase/muconate lactonizing enzyme
著者Fedorov, A.A, Fedorov, E.V, Rakus, J.F, Vick, J.E, Gerlt, J.A, Almo, S.C.
登録日2007-07-07
公開日2007-10-30
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Evolution of enzymatic activities in the enolase superfamily: D-Mannonate dehydratase from Novosphingobium aromaticivorans.
Biochemistry, 46, 2007
1A6Z
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HFE (HUMAN) HEMOCHROMATOSIS PROTEIN
分子名称: BETA-2-MICROGLOBULIN, HFE
著者Lebron, J.A, Bennett, M.J, Vaughn, D.E, Chirino, A.J, Snow, P.M, Mintier, G.A, Feder, J.N, Bjorkman, P.J.
登録日1998-03-04
公開日1999-03-23
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Crystal structure of the hemochromatosis protein HFE and characterization of its interaction with transferrin receptor.
Cell(Cambridge,Mass.), 93, 1998
6UOS
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MicroED structure of OsPYL/RCAR5 (24-29) at 6 e-/A^2
分子名称: Abscisic acid receptor PYL5
著者Gallagher-Jones, M, Richards, L.S, Lee, S, Rodriguez, J.A.
登録日2019-10-15
公開日2020-05-13
最終更新日2024-03-13
実験手法ELECTRON CRYSTALLOGRAPHY (0.9 Å)
主引用文献Atomic structures determined from digitally defined nanocrystalline regions
Iucrj, 7, 2020
6UOW
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MicroED structure of OsPYL/RCAR5 (24-29) at 12 e-/A^2
分子名称: Abscisic acid receptor PYL5
著者Gallagher-Jones, M, Richards, L.S, Lee, S, Rodriguez, J.A.
登録日2019-10-15
公開日2020-05-13
最終更新日2024-03-13
実験手法ELECTRON CRYSTALLOGRAPHY (1.2 Å)
主引用文献Atomic structures determined from digitally defined nanocrystalline regions
Iucrj, 7, 2020
2QVW
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Structure of Giardia Dicer refined against twinned data
分子名称: GLP_546_48378_50642, MANGANESE (II) ION
著者Doudna, J.A, MacRae, I.J.
登録日2007-08-09
公開日2007-09-25
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献An unusual case of pseudo-merohedral twinning in orthorhombic crystals of Dicer
Acta Crystallogr.,Sect.D, 63, 2007
7QSJ
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Methylmannose polysaccharide hydrolase MmpH from M. hassiacum
分子名称: GLYCEROL, MAGNESIUM ION, Methylmannose polysaccharide hydrolase (MmpH), ...
著者Ripoll-Rozada, J, Manso, J.A, Pereira, P.J.B.
登録日2022-01-13
公開日2023-01-25
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献Self-recycling and partially conservative replication of mycobacterial methylmannose polysaccharides.
Commun Biol, 6, 2023
6UOP
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OsPYL/RCAR5 (24 - 29) solved by nanobeam diffraction tomography
分子名称: Abscisic acid receptor PYL5
著者Gallagher-Jones, M, Richards, L.S, Lee, S, Rodriguez, J.A.
登録日2019-10-15
公開日2020-05-13
最終更新日2024-03-13
実験手法ELECTRON CRYSTALLOGRAPHY (1.351 Å)
主引用文献Atomic structures determined from digitally defined nanocrystalline regions
Iucrj, 7, 2020
7QON
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Monoclinic triose phosphate isomerase from Fasciola hepatica.
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, SODIUM ION, ...
著者Kontellas, G, Isupov, M.N, Littlechild, J.A.
登録日2021-12-24
公開日2023-01-18
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.51 Å)
主引用文献Monoclinic triose phosphate isomerase from Fasciola hepatica.
To Be Published
6UOR
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BU of 6uor by Molmil
MicroED structure of OsPYL/RCAR5 (24-29) at 3 e-/A^2
分子名称: Abscisic acid receptor PYL5
著者Gallagher-Jones, M, Richards, L.S, Lee, S, Rodriguez, J.A.
登録日2019-10-15
公開日2020-05-13
最終更新日2024-03-13
実験手法ELECTRON CRYSTALLOGRAPHY (0.9 Å)
主引用文献Atomic structures determined from digitally defined nanocrystalline regions
Iucrj, 7, 2020
6UOU
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MicroED structure of OsPYL/RCAR5 (24-29) at 9 e-/A^2
分子名称: Abscisic acid receptor PYL5
著者Gallagher-Jones, M, Richards, L.S, Lee, S, Rodriguez, J.A.
登録日2019-10-15
公開日2020-05-13
最終更新日2024-03-13
実験手法ELECTRON CRYSTALLOGRAPHY (1.04 Å)
主引用文献Atomic structures determined from digitally defined nanocrystalline regions
Iucrj, 7, 2020
1A9M
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G48H MUTANT OF HIV-1 PROTEASE IN COMPLEX WITH A PEPTIDIC INHIBITOR U-89360E
分子名称: HIV-1 PROTEASE, N-[[1-[N-ACETAMIDYL]-[1-CYCLOHEXYLMETHYL-2-HYDROXY-4-ISOPROPYL]-BUT-4-YL]-CARBONYL]-GLUTAMINYL-ARGINYL-AMIDE
著者Hong, L, Zhang, X.-J, Foundling, S, Hartsuck, J.A, Tang, J.
登録日1998-04-08
公開日1998-06-17
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structure of a G48H mutant of HIV-1 protease explains how glycine-48 replacements produce mutants resistant to inhibitor drugs.
FEBS Lett., 420, 1997
1AJ4
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STRUCTURE OF CALCIUM-SATURATED CARDIAC TROPONIN C, NMR, 1 STRUCTURE
分子名称: CALCIUM ION, TROPONIN C
著者Sia, S.K, Li, M.X, Spyracopoulos, L, Gagne, S.M, Liu, W, Putkey, J.A, Sykes, B.D.
登録日1997-05-14
公開日1998-05-20
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Structure of cardiac muscle troponin C unexpectedly reveals a closed regulatory domain.
J.Biol.Chem., 272, 1997
2QG6
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Crystal structure of human nicotinamide riboside kinase (NRK1) in complex with nicotinamide mononucleotide (NMN)
分子名称: BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE, Nicotinamide riboside kinase 1, PHOSPHATE ION
著者Khan, J.A, Xiang, S, Tong, L.
登録日2007-06-28
公開日2007-10-02
最終更新日2017-10-18
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Crystal structure of human nicotinamide riboside kinase
Structure, 15, 2007
7QSG
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Methylmannose polysaccharide mannosyltransferase from M. hassiacum
分子名称: D-inositol 3-phosphate glycosyltransferase
著者Manso, J.A, Ripoll-Rozada, J, Pereira, P.J.B.
登録日2022-01-13
公開日2023-01-25
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.75 Å)
主引用文献Self-recycling and partially conservative replication of mycobacterial methylmannose polysaccharides.
Commun Biol, 6, 2023
2QX6
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Crystal Structure of Quinone Reductase II
分子名称: FLAVIN-ADENINE DINUCLEOTIDE, N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide, Ribosyldihydronicotinamide dehydrogenase [quinone], ...
著者Calamini, B, Santarsiero, B.D, Boutin, J.A, Mesecar, A.D.
登録日2007-08-10
公開日2008-09-09
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Kinetic, thermodynamic and X-ray structural insights into the interaction of melatonin and analogues with quinone reductase 2.
Biochem.J., 413, 2008

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