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2OTY
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BU of 2oty by Molmil
1,2-dichlorobenzene in complex with T4 Lysozyme L99A
分子名称: 1,2-DICHLOROBENZENE, BETA-MERCAPTOETHANOL, Lysozyme, ...
著者Graves, A.P, Shoichet, B.K.
登録日2007-02-09
公開日2007-08-07
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.83 Å)
主引用文献Predicting absolute ligand binding free energies to a simple model site.
J.Mol.Biol., 371, 2007
2ONM
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BU of 2onm by Molmil
Human Mitochondrial Aldehyde Dehydrogenase Asian Variant, ALDH2*2, complexed with NAD+
分子名称: 1,2-ETHANEDIOL, ADENOSINE-5'-DIPHOSPHATE, Aldehyde dehydrogenase, ...
著者Larson, H.N, Hurley, T.D.
登録日2007-01-24
公開日2007-03-06
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structural and functional consequences of coenzyme binding to the inactive asian variant of mitochondrial aldehyde dehydrogenase: roles of residues 475 and 487.
J.Biol.Chem., 282, 2007
3H0X
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BU of 3h0x by Molmil
Crystal structure of peptide-binding domain of Kar2 protein from Saccharomyces cerevisiae
分子名称: 78 kDa glucose-regulated protein homolog
著者Osipiuk, J, Bigelow, L, Gu, M, Sahi, C, Craig, E.A, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2009-04-10
公開日2009-04-21
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.92 Å)
主引用文献X-ray crystal structure of peptide-binding domain of Kar2 protein from Saccharomyces cerevisiae.
To be Published
3H16
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BU of 3h16 by Molmil
Crystal structure of a bacteria TIR domain, PdTIR from Paracoccus denitrificans
分子名称: SULFATE ION, TIR protein
著者Chan, S.L, Low, L.Y, Santelli, E, Pascual, J.
登録日2009-04-11
公開日2009-06-16
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Molecular Mimicry in Innate Immunity: CRYSTAL STRUCTURE OF A BACTERIAL TIR DOMAIN.
J.Biol.Chem., 284, 2009
3H5N
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BU of 3h5n by Molmil
Crystal structure of E. coli MccB + ATP
分子名称: ADENOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, MccB protein, ...
著者Regni, C.A, Roush, R.F, Miller, D, Nourse, A, Walsh, C.T, Schulman, B.A.
登録日2009-04-22
公開日2009-06-16
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献How the MccB bacterial ancestor of ubiquitin E1 initiates biosynthesis of the microcin C7 antibiotic.
Embo J., 28, 2009
2OO3
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BU of 2oo3 by Molmil
Crystal structure of protein LPL1258 from Legionella pneumophila str. Philadelphia 1, Pfam DUF519
分子名称: Protein involved in catabolism of external DNA, SULFATE ION
著者Bonanno, J.B, Freeman, J, Bain, K.T, Slocombe, A, Reyes, C, Ozyurt, S, Smyth, L, Atwell, S, Sauder, J.M, Burley, S.K, Almo, S.C, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2007-01-25
公開日2007-02-06
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Crystal structure of the hypothetical lpl1258 protein from Legionella pneumophila
To be Published
3TUI
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BU of 3tui by Molmil
Inward facing conformations of the MetNI methionine ABC transporter: CY5 native crystal form
分子名称: ADENOSINE-5'-DIPHOSPHATE, D-methionine transport system permease protein metI, Methionine import ATP-binding protein MetN
著者Johnson, E, Nguyen, P.T, Rees, D.C.
登録日2011-09-16
公開日2011-11-30
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Inward facing conformations of the MetNI methionine ABC transporter: Implications for the mechanism of transinhibition.
Protein Sci., 21, 2012
3GKB
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BU of 3gkb by Molmil
Crystal structure of a putative enoyl-CoA hydratase from Streptomyces avermitilis
分子名称: GLYCEROL, Putative enoyl-CoA hydratase
著者Bonanno, J.B, Freeman, J, Bain, K.T, Chang, S, Romero, R, Wasserman, S, Sauder, J.M, Burley, S.K, Almo, S.C, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2009-03-10
公開日2009-03-24
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal structure of a putative enoyl-CoA hydratase from Streptomyces avermitilis
To be Published
3U7E
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BU of 3u7e by Molmil
Crystal structure of mPNKP catalytic fragment (D170A)
分子名称: Bifunctional polynucleotide phosphatase/kinase, GLYCEROL, MAGNESIUM ION, ...
著者Coquelle, N, Havali, Z, Bernstein, N, Green, R, Glover, J.N.M.
登録日2011-10-13
公開日2011-12-14
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Structural basis for the phosphatase activity of polynucleotide kinase/phosphatase on single- and double-stranded DNA substrates.
Proc.Natl.Acad.Sci.USA, 108, 2011
2ONN
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BU of 2onn by Molmil
Arg475Gln Mutant of Human Mitochondrial Aldehyde Dehydrogenase, Apo form
分子名称: Aldehyde dehydrogenase
著者Larson, H.N, Hurley, T.D.
登録日2007-01-24
公開日2007-03-06
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.75 Å)
主引用文献Structural and functional consequences of coenzyme binding to the inactive asian variant of mitochondrial aldehyde dehydrogenase: roles of residues 475 and 487.
J.Biol.Chem., 282, 2007
2OPD
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BU of 2opd by Molmil
Structure of the Neisseria meningitidis minor Type IV pilin, PilX
分子名称: PilX
著者Dyer, D.H, Helaine, S, Pelicic, V, Forest, K.T.
登録日2007-01-29
公開日2007-10-23
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献3D structure/function analysis of PilX reveals how minor pilins can modulate the virulence properties of type IV pili.
Proc.Natl.Acad.Sci.Usa, 104, 2007
3GNL
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BU of 3gnl by Molmil
Structure of uncharacterized protein (LMOf2365_1472) from Listeria monocytogenes serotype 4b
分子名称: uncharacterized protein, DUF633, LMOf2365_1472
著者Ramagopal, U.A, Toro, R, Burley, S.K, Almo, S.C, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2009-03-17
公開日2009-04-21
最終更新日2021-02-10
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Structure of uncharacterized protein (LMOf2365_1472) from Listeria monocytogenes serotype 4b
To be Published
3H6R
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BU of 3h6r by Molmil
Clitocypin, a beta-trefoil cysteine protease inhibitor
分子名称: Clitocypin analog
著者Renko, M, Sabotic, J, Brzin, J, Turk, D.
登録日2009-04-23
公開日2009-10-20
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.948 Å)
主引用文献Versatile loops in mycocypins inhibit three protease families.
J.Biol.Chem., 285, 2010
3GNU
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BU of 3gnu by Molmil
Toxin fold as basis for microbial attack and plant defense
分子名称: 25 kDa protein elicitor, CHLORIDE ION, GUANIDINE
著者Ottmann, C, Luberacki, B, Kuefner, I, Koch, W, Brunner, F, Weyand, M, Mattinen, L, Pirhonen, M, Anderluh, G, Seitz, H.U, Nuernberger, T, Oecking, C.
登録日2009-03-18
公開日2009-06-09
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献A common toxin fold mediates microbial attack and plant defense
Proc.Natl.Acad.Sci.USA, 106, 2009
3U9O
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BU of 3u9o by Molmil
Crystal structure of Staphylococcal nuclease variant NVIAGA/N100G at cryogenic temperature
分子名称: PHOSPHATE ION, Thermonuclease
著者Schlessman, J.L, Doctrow, B.M, Garcia-Moreno E, B.
登録日2011-10-19
公開日2011-11-23
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Local flexibility as a determinant of pKa values of surface ionizable groups in proteins
To be Published
2OQI
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BU of 2oqi by Molmil
Human Dipeptidyl Peptidase IV (DPP4) with Piperidinone-constrained phenethylamine
分子名称: (4R,5R)-5-AMINO-1-[2-(1,3-BENZODIOXOL-5-YL)ETHYL]-4-(2,4,5-TRIFLUOROPHENYL)PIPERIDIN-2-ONE, Dipeptidyl peptidase 4 (Dipeptidyl peptidase IV) (DPP IV) (T-cell activation antigen CD26) (TP103) (Adenosine deaminase complexing protein 2) (ADABP)
著者Pei, Z, Li, X, von Geldern, T.W, Longenecker, K.L, Pireh, D, Stewart, K.D, Backes, B.J, Lai, C, Lubben, T.H, Ballaron, S.J, Beno, D.W, Kempf-Grote, A.J, Sham, H.L, Trevillyan, J.M.
登録日2007-01-31
公開日2007-04-03
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Discovery and Structure-Activity Relationships of Piperidinone- and Piperidine-Constrained Phenethylamines as Novel, Potent, and Selective Dipeptidyl Peptidase IV Inhibitors.
J.Med.Chem., 50, 2007
2OQL
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BU of 2oql by Molmil
Structure of Phosphotriesterase mutant H254Q/H257F
分子名称: 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, GLYCEROL, Parathion hydrolase, ...
著者Kim, J, Tsai, P, Raushel, F.M, Almo, S.C.
登録日2007-01-31
公開日2008-02-19
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal Structure of PTE mutant H254Q/H257F
To be Published
3GOA
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BU of 3goa by Molmil
Crystal structure of the Salmonella typhimurium FadA 3-ketoacyl-CoA thiolase
分子名称: 3-ketoacyl-CoA thiolase, CALCIUM ION, CHLORIDE ION, ...
著者Anderson, S.M, Skarina, T, Onopriyenko, O, Wawrzak, Z, Papazisi, L, Savchenko, A, Anderson, W.F, Center for Structural Genomics of Infectious Diseases (CSGID)
登録日2009-03-18
公開日2009-03-31
最終更新日2017-11-01
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献

2ORI
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BU of 2ori by Molmil
Crystal structure of a thermostable mutant of Bacillus subtilis Adenylate Kinase (A193V/Q199R/)
分子名称: Adenylate kinase, BIS(ADENOSINE)-5'-PENTAPHOSPHATE, MAGNESIUM ION, ...
著者Counago, R, Shamoo, Y, Wilson, C.J, Wu, G, Myers, J.
登録日2007-02-02
公開日2008-01-15
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal structure of a thermostable mutant of Bacillus subtilis Adenylate Kinase (A193V/Q199R/)
To be Published
3GP4
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BU of 3gp4 by Molmil
Crystal structure of putative MerR family transcriptional regulator from listeria monocytogenes
分子名称: D-METHIONINE, GLYCEROL, SODIUM ION, ...
著者Ramagopal, U.A, Toro, R, Morano, C, Burley, S.K, Almo, S.C, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2009-03-20
公開日2009-04-21
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Structure of putative MerR family transcriptional regulator from Listeria monocytogenes
To be published
2OU0
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BU of 2ou0 by Molmil
1-methylpyrrole in complex with T4 Lysozyme L99A
分子名称: 1-METHYL-1H-PYRROLE, Lysozyme, PHOSPHATE ION
著者Graves, A.P, Shoichet, B.K.
登録日2007-02-09
公開日2007-08-07
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.94 Å)
主引用文献Predicting absolute ligand binding free energies to a simple model site.
J.Mol.Biol., 371, 2007
3TLE
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BU of 3tle by Molmil
Microcin C7 self immunity protein MccF in complex with glutamyl sulfamoyl adenylate
分子名称: 1,2-ETHANEDIOL, MccF, O5'-(L-GLUTAMYL-SULFAMOYL)-ADENOSINE
著者Agarwal, V, Nair, S.K.
登録日2011-08-29
公開日2012-02-29
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献Structure and function of a serine carboxypeptidase adapted for degradation of the protein synthesis antibiotic microcin C7.
Proc.Natl.Acad.Sci.USA, 109, 2012
3GQK
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BU of 3gqk by Molmil
Crystal Structure of the Bacteriophage phi29 gene product 12 C-terminal fragment in complex with ATP
分子名称: ADENOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, Preneck appendage protein
著者Xiang, Y, Rossmann, M.G.
登録日2009-03-24
公開日2009-05-26
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Crystallographic insights into the autocatalytic assembly mechanism of a bacteriophage tail spike.
Mol.Cell, 34, 2009
3U0F
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BU of 3u0f by Molmil
The structure of Beta-ketoacyl synthase from Brucella melitensis bound to the fragment 7-hydroxycoumarin
分子名称: 7-hydroxy-2H-chromen-2-one, Beta-ketoacyl synthase, CHLORIDE ION, ...
著者Seattle Structural Genomics Center for Infectious Disease, Seattle Structural Genomics Center for Infectious Disease (SSGCID)
登録日2011-09-28
公開日2011-10-12
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.25 Å)
主引用文献Structural characterization of beta-ketoacyl ACP synthase I bound to platencin and fragment screening molecules at two substrate binding sites.
Proteins, 88, 2020
3GQO
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BU of 3gqo by Molmil
Crystal structure of macro domain of Venezuelan Equine Encephalitis virus in complex with ADP-ribose
分子名称: ADENOSINE-5-DIPHOSPHORIBOSE, Non-structural protein 3
著者Malet, H, Jamal, S, Coutard, B, Ferron, F, Canard, B.
登録日2009-03-24
公開日2009-07-21
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献The crystal structures of Chikungunya and Venezuelan equine encephalitis virus nsP3 macro domains define a conserved adenosine binding pocket
J.Virol., 83, 2009

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