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1SBI
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BU of 1sbi by Molmil
SUBTILISIN BPN' 8397 (E.C. 3.4.21.14) MUTANT (M50F, N76D, G169A, Q206C, N218S)
分子名称: CALCIUM ION, SUBTILISIN 8397
著者Kidd, R.D, Yennawar, H.P, Farber, G.K.
登録日1995-09-01
公開日1995-12-07
最終更新日2024-06-05
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献A weak calcium binding site in subtilisin BPN' has a dramatic effect on protein stability.
J.Am.Chem.Soc., 118, 1996
4EMN
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BU of 4emn by Molmil
Crystal structure of RpfB catalytic domain in complex with benzamidine
分子名称: BENZAMIDINE, Probable resuscitation-promoting factor rpfB, SULFATE ION
著者Ruggiero, A, Marchant, J, Squeglia, F, Makarov, V, De Simone, A, Berisio, R.
登録日2012-04-12
公開日2013-02-27
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.17 Å)
主引用文献Molecular determinants of inactivation of the resuscitation promoting factor B from Mycobacterium tuberculosis.
J.Biomol.Struct.Dyn., 31, 2013
1SUB
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BU of 1sub by Molmil
CALCIUM-INDEPENDENT SUBTILISIN BY DESIGN
分子名称: ACETONE, CALCIUM ION, POTASSIUM ION, ...
著者Gallagher, T, Bryan, P, Gilliland, G.L.
登録日1992-06-10
公開日1994-01-31
最終更新日2021-11-03
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Calcium-independent subtilisin by design.
Proteins, 16, 1993
6CMH
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BU of 6cmh by Molmil
SYNTHETIC LINEAR MODIFIED ENDOTHELIN-1 AGONIST
分子名称: PROTEIN (ENDOTHELIN-1)
著者Hewage, C.M, Jiang, L, Parkinson, J.A, Ramage, R, Sadler, I.H.
登録日1998-09-03
公開日1999-09-29
最終更新日2023-12-27
実験手法SOLUTION NMR
主引用文献Solution structure of a novel ETB receptor selective agonist ET1-21 [Cys(Acm)1,15, Aib3,11, Leu7] by nuclear magnetic resonance spectroscopy and molecular modelling.
J.Pept.Res., 53, 1999
5XJY
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BU of 5xjy by Molmil
Cryo-EM structure of human ABCA1
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, ATP-binding cassette sub-family A member 1, ...
著者Qian, H.W, Yan, N, Gong, X.
登録日2017-05-04
公開日2017-06-07
最終更新日2020-07-29
実験手法ELECTRON MICROSCOPY (4.1 Å)
主引用文献Structure of the Human Lipid Exporter ABCA1.
Cell, 169, 2017
3GST
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BU of 3gst by Molmil
STRUCTURE OF THE XENOBIOTIC SUBSTRATE BINDING SITE OF A GLUTATHIONE S-TRANSFERASE AS REVEALED BY X-RAY CRYSTALLOGRAPHIC ANALYSIS OF PRODUCT COMPLEXES WITH THE DIASTEREOMERS OF 9-(S-GLUTATHIONYL)-10-HYDROXY-9, 10-DIHYDROPHENANTHRENE
分子名称: (9R,10R)-9-(S-GLUTATHIONYL)-10-HYDROXY-9,10-DIHYDROPHENANTHRENE, GLUTATHIONE S-TRANSFERASE, SULFATE ION
著者Ji, X, Ammon, H.L, Armstrong, R.N, Gilliland, G.L.
登録日1993-06-07
公開日1993-10-31
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structure and function of the xenobiotic substrate binding site of a glutathione S-transferase as revealed by X-ray crystallographic analysis of product complexes with the diastereomers of 9-(S-glutathionyl)-10-hydroxy-9,10-dihydrophenanthrene.
Biochemistry, 33, 1994
3WJM
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Crystal structure of Bombyx mori Sp2/Sp3 heterohexamer
分子名称: Arylphorin, Silkworm storage protein, alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-[alpha-D-mannopyranose-(1-6)-alpha-D-mannopyranose-(1-6)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Yuan, Y.A, Hou, Y.
登録日2013-10-11
公開日2014-09-24
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Crystal structure of Bombyx mori arylphorins reveals a 3:3 heterohexamer with multiple papain cleavage sites
Protein Sci., 23, 2014
8UTG
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BU of 8utg by Molmil
An RNA G-Quadruplex from the NS5 gene in the West Nile Virus Genome
分子名称: AMMONIUM ION, POTASSIUM ION, RNA (5'-R(*UP*AP*UP*GP*GP*AP*AP*GP*AP*GP*GP*CP*GP*GP*UP*UP*GP*GP*UP*AP*U)-3')
著者Terrell, J.R, Le, T.T, Wilson, W.D, Siemer, J.L.
登録日2023-10-31
公開日2024-06-19
最終更新日2024-07-17
実験手法X-RAY DIFFRACTION (1.97 Å)
主引用文献Structure of an RNA G-quadruplex from the West Nile virus genome.
Nat Commun, 15, 2024
1D7Y
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BU of 1d7y by Molmil
CRYSTAL STRUCTURE OF NADH-DEPENDENT FERREDOXIN REDUCTASE, BPHA4
分子名称: FERREDOXIN REDUCTASE, FLAVIN-ADENINE DINUCLEOTIDE
著者Senda, T, Yamada, T, Sakurai, N, Kubota, M, Nishizaki, T, Masai, E, Fukuda, M, Mitsui, Y.
登録日1999-10-21
公開日2000-12-20
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Crystal structure of NADH-dependent ferredoxin reductase component in biphenyl dioxygenase.
J.Mol.Biol., 304, 2000
5MWG
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BU of 5mwg by Molmil
Crystal structure of the human BRPF1 bromodomain in complex with BZ091
分子名称: NITRATE ION, Peregrin, ~{N}-[1,4-dimethyl-2,3-bis(oxidanylidene)-7-piperidin-1-yl-quinoxalin-6-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
著者Zhu, J, Caflisch, A.
登録日2017-01-18
公開日2018-02-14
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Structure-based discovery of selective BRPF1 bromodomain inhibitors.
Eur J Med Chem, 155, 2018
6CBD
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BU of 6cbd by Molmil
Crystal Structure of Human Argonaute2 Bound to Three Tryptophans
分子名称: Guide RNA, ISOPROPYL ALCOHOL, MAGNESIUM ION, ...
著者Sheu-Gruttadauria, J, MacRae, I.J.
登録日2018-02-02
公開日2018-04-18
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2.203 Å)
主引用文献Phase Transitions in the Assembly and Function of Human miRISC.
Cell, 173, 2018
1TGM
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BU of 1tgm by Molmil
Crystal structure of a complex formed between group II phospholipase A2 and aspirin at 1.86 A resolution
分子名称: 2-(ACETYLOXY)BENZOIC ACID, CALCIUM ION, Phospholipase A2, ...
著者Singh, N, Jabeen, T, Sharma, S, Bhushan, A, Singh, T.P.
登録日2004-05-28
公開日2004-06-08
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (1.86 Å)
主引用文献Crystal structure of a complex formed between group II phospholipase A2 and aspirin at 1.86 A resolution
To be Published
1TJK
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BU of 1tjk by Molmil
Crystal structure of the complex formed between group II phospholipase A2 with a designed pentapeptide, Phe- Leu- Ser- Thr- Lys at 1.2 A resolution
分子名称: Phospholipase A2, SULFATE ION, synthetic peptide
著者Singh, N, Jabeen, T, Somvanshi, R.K, Sharma, S, Perbandt, M, Dey, S, Betzel, C, Singh, T.P.
登録日2004-06-06
公開日2004-06-15
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (1.25 Å)
主引用文献Crystal structure of the complex formed between group II phospholipase A2 with a designed pentapeptide, Phe - Leu - Ser - Thr - Lys at 1.2 A resolution
To be Published
1SUE
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BU of 1sue by Molmil
SUBTILISIN BPN' FROM BACILLUS AMYLOLIQUEFACIENS, MUTANT
分子名称: DIISOPROPYL PHOSPHONATE, SODIUM ION, SUBTILISIN BPN'
著者Gallagher, D.T, Bryan, P, Pan, Q, Gilliland, G.L.
登録日1998-02-17
公開日1998-10-14
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Mechanism of ionic strength dependence of crystal growth rates in a subtilisin variant.
J.Cryst.Growth, 193, 1998
1ST2
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BU of 1st2 by Molmil
THE THREE-DIMENSIONAL STRUCTURE OF BACILLUS AMYLOLIQUEFACIENS SUBTILISIN AT 1.8 ANGSTROMS AND AN ANALYSIS OF THE STRUCTURAL CONSEQUENCES OF PEROXIDE INACTIVATION
分子名称: CALCIUM ION, SUBTILISIN BPN', SULFATE ION
著者Bott, R.
登録日1990-03-21
公開日1991-07-15
最終更新日2024-06-05
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献The three-dimensional structure of Bacillus amyloliquefaciens subtilisin at 1.8 A and an analysis of the structural consequences of peroxide inactivation.
J.Biol.Chem., 263, 1988
1D48
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BU of 1d48 by Molmil
STRUCTURE OF THE PURE-SPERMINE FORM OF Z-DNA (MAGNESIUM FREE) AT 1 ANGSTROM RESOLUTION
分子名称: DNA (5'-D(*CP*GP*CP*GP*CP*G)-3'), SPERMINE
著者Egli, M, Williams, L.D, Gao, Q, Rich, A.
登録日1991-09-11
公開日1992-04-15
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1 Å)
主引用文献Structure of the pure-spermine form of Z-DNA (magnesium free) at 1-A resolution.
Biochemistry, 30, 1991
3GUR
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BU of 3gur by Molmil
Crystal Structure of mu class glutathione S-transferase (GSTM2-2) in complex with glutathione and 6-(7-Nitro-2,1,3-benzoxadiazol-4-ylthio)hexanol (NBDHEX)
分子名称: 1,2-ETHANEDIOL, GLUTATHIONE, Glutathione S-transferase Mu 2, ...
著者Federici, L, Lo Sterzo, C, Di Matteo, A, Scaloni, F, Federici, G, Caccuri, A.M.
登録日2009-03-30
公開日2009-10-27
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structural basis for the binding of the anticancer compound 6-(7-nitro-2,1,3-benzoxadiazol-4-ylthio)hexanol to human glutathione s-transferases
Cancer Res., 69, 2009
4YU9
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BU of 4yu9 by Molmil
Crystal Structure of double mutant Y115E Y117E human Glutaminyl Cyclase
分子名称: 1,2-ETHANEDIOL, Glutaminyl-peptide cyclotransferase, SULFATE ION, ...
著者Di Pisa, F, Pozzi, C, Benvenuti, M, Mangani, S.
登録日2015-03-18
公開日2015-08-05
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献The soluble Y115E-Y117E variant of human glutaminyl cyclase is a valid target for X-ray and NMR screening of inhibitors against Alzheimer disease.
Acta Crystallogr.,Sect.F, 71, 2015
1OAP
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BU of 1oap by Molmil
Mad structure of the periplasmique domain of the Escherichia coli PAL protein
分子名称: PEPTIDOGLYCAN-ASSOCIATED LIPOPROTEIN, SULFATE ION
著者Abergel, C, Walburger, A, Bouveret, E, Claverie, J.M.
登録日2003-01-20
公開日2004-02-13
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.93 Å)
主引用文献Crystallization and preliminary crystallographic study of the peptidoglycan-associated lipoprotein from Escherichia coli.
Acta Crystallogr.,Sect.D, 57, 2001
4EM7
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BU of 4em7 by Molmil
Crystal structure of a topoisomerase ATP inhibitor
分子名称: 3-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]propanoic acid, DNA topoisomerase IV, B subunit
著者Boriack-Sjodin, P.A, Manchester, J.
登録日2012-04-11
公開日2012-08-01
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Discovery of a novel azaindole class of antibacterial agents targeting the ATPase domains of DNA gyrase and Topoisomerase IV.
Bioorg.Med.Chem.Lett., 22, 2012
3H4K
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BU of 3h4k by Molmil
Crystal structure of the wild type Thioredoxin glutatione reductase from Schistosoma mansoni in complex with auranofin
分子名称: FLAVIN-ADENINE DINUCLEOTIDE, GLUTATHIONE, GOLD ION, ...
著者Angelucci, F, Dimastrogiovanni, D, Miele, A.E, Boumis, G, Brunori, M, Bellelli, A.
登録日2009-04-20
公開日2009-08-25
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.55 Å)
主引用文献Inhibition of Schistosoma mansoni thioredoxin-glutathione reductase by auranofin: structural and kinetic aspects.
J.Biol.Chem., 284, 2009
1DD7
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BU of 1dd7 by Molmil
MURINE INDUCIBLE NITRIC OXIDE SYNTHASE OXYGENASE DOMAIN (DELTA 114) (N-[(1,3-BENZODIOXOL-5-YL)METHYL]-1-[2-(1H-IMIDAZOL-1-YL)PYRIMIDIN-4-YL]-4-(METHOXYCARBONYL)-PIPERAZINE-2-ACETAMIDE COMPLEX
分子名称: INDUCIBLE NITRIC OXIDE SYNTHASE, PROTOPORPHYRIN IX CONTAINING FE, SULFITE ION, ...
著者Adler, M, Whitlow, M.
登録日1999-11-08
公開日2000-03-29
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Allosteric inhibitors of inducible nitric oxide synthase dimerization discovered via combinatorial chemistry.
Proc.Natl.Acad.Sci.USA, 97, 2000
1U3T
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BU of 1u3t by Molmil
Crystal Structure of Human Alcohol Dehydrogenase Alpha-Alpha Isoform Complexed with N-Cyclopentyl-N-Cyclobutylformamide Determined to 2.5 Angstrom Resolution
分子名称: Alcohol dehydrogenase alpha chain, CYCLOBUTYL(CYCLOPENTYL)FORMAMIDE, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ...
著者Gibbons, B.J, Hurley, T.D.
登録日2004-07-23
公開日2004-10-26
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.49 Å)
主引用文献Structure of three class I human alcohol dehydrogenases complexed with isoenzyme specific formamide inhibitors
Biochemistry, 43, 2004
1UBN
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BU of 1ubn by Molmil
SELENOSUBTILISIN BPN
分子名称: CALCIUM ION, PROTEIN (SELENOSUBTILISIN BPN)
著者McRee, D.E, McTigue, M, Hilvert, D.
登録日1999-06-02
公開日1999-06-08
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Electric fields in active sites: substrate switching from null to strong fields in thiol- and selenol-subtilisins.
Biochemistry, 38, 1999
1TW7
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Wide Open 1.3A Structure of a Multi-drug Resistant HIV-1 Protease Represents a Novel Drug Target
分子名称: SODIUM ION, protease
著者Martin, P, Vickrey, J.F, Proteasa, G, Jimenez, Y.L, Wawrzak, Z, Winters, M.A, Merigan, T.C, Kovari, L.C.
登録日2004-06-30
公開日2005-07-19
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献Wide Open 1.3A Structure of a Multi-drug Resistant HIV-1 Protease Represents a Novel Drug Target
Structure, 13, 2005

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