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2F8H
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BU of 2f8h by Molmil
Structure of acetylcitrulline deacetylase from Xanthomonas campestris in metal-free form
Descriptor: aectylcitrulline deacetylase
Authors:Shi, D, Yu, X, Roth, L, Allewell, N.M, Tuchman, M.
Deposit date:2005-12-02
Release date:2006-09-26
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Structure of a novel N-acetyl-L-citrulline deacetylase from Xanthomonas campestris
Biophys.Chem., 126, 2007
7E36
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BU of 7e36 by Molmil
A [6+4]-cycloaddition adduct is the biosynthetic intermediate in streptoseomycin biosynthesis
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Alkanesulfonate monooxygenase SsuD/methylene tetrahydromethanopterin reductase-like flavin-dependent oxidoreductase (Luciferase family), ...
Authors:Zhang, B, Ge, H.M.
Deposit date:2021-02-08
Release date:2021-03-10
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:A [6+4]-cycloaddition adduct is the biosynthetic intermediate in streptoseomycin biosynthesis.
Nat Commun, 12, 2021
2LRK
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BU of 2lrk by Molmil
Solution Structures of the IIA(Chitobiose)-HPr complex of the N,N'-Diacetylchitobiose
Descriptor: N,N'-diacetylchitobiose-specific phosphotransferase enzyme IIA component, Phosphocarrier protein HPr
Authors:Cai, M, Jung, Y, Clore, M.
Deposit date:2012-04-06
Release date:2012-05-16
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Solution Structure of the IIAChitobiose-HPr Complex of the N,N'-Diacetylchitobiose Branch of the Escherichia coli Phosphotransferase System.
J.Biol.Chem., 287, 2012
2PNF
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BU of 2pnf by Molmil
Structure of Aquifex Aeolicus FabG 3-oxoacyl-(acyl-carrier protein) reductase
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 3-oxoacyl-[acyl-carrier-protein] reductase, PENTAETHYLENE GLYCOL
Authors:Mao, Q, Umland, T.C.
Deposit date:2007-04-24
Release date:2007-05-01
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structure of Aquifex Aeolicus FabG 3-oxoacyl-(acyl-carrier protein) reductase
To be Published
4U74
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BU of 4u74 by Molmil
Crystal structure of 4-phenylimidazole bound form of human indoleamine 2,3-dioxygenase (G262A mutant)
Descriptor: 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, 4-PHENYL-1H-IMIDAZOLE, Indoleamine 2,3-dioxygenase 1, ...
Authors:Sugimoto, H, Horitani, M, Kometani, E, Shiro, Y.
Deposit date:2014-07-30
Release date:2015-09-02
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.31 Å)
Cite:Conformation and Mobility of Active Site Loop is Critical for Substrate Binding and Inhibition in Human Indoleamine 2,3-Dioxygenase
to be published
3GXI
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BU of 3gxi by Molmil
Crystal structure of acid-beta-glucosidase at pH 5.5
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Glucosylceramidase, PHOSPHATE ION
Authors:Lieberman, R.L.
Deposit date:2009-04-02
Release date:2009-05-05
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (1.84 Å)
Cite:Effects of pH and iminosugar pharmacological chaperones on lysosomal glycosidase structure and stability.
Biochemistry, 48, 2009
4U7F
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BU of 4u7f by Molmil
Reduced quinone reductase 2 in complex with CK2 inhibitor DMAT
Descriptor: 4,5,6,7-TETRABROMO-N,N-DIMETHYL-1H-BENZIMIDAZOL-2-AMINE, FLAVIN-ADENINE DINUCLEOTIDE, Ribosyldihydronicotinamide dehydrogenase [quinone], ...
Authors:Leung, K.K, Shilton, B.H.
Deposit date:2014-07-30
Release date:2015-02-11
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Quinone Reductase 2 Is an Adventitious Target of Protein Kinase CK2 Inhibitors TBBz (TBI) and DMAT.
Biochemistry, 54, 2015
6KDE
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BU of 6kde by Molmil
Crystal structure of the alpha beta heterodimer of human IDH3 in complex with Ca(2+)
Descriptor: CALCIUM ION, Isocitrate dehydrogenase [NAD] subunit alpha, mitochondrial, ...
Authors:Sun, P, Ding, J.
Deposit date:2019-07-02
Release date:2019-09-25
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.999 Å)
Cite:Molecular basis for the function of the alpha beta heterodimer of human NAD-dependent isocitrate dehydrogenase.
J.Biol.Chem., 294, 2019
6C7N
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BU of 6c7n by Molmil
Monoclinic form of malic enzyme from sorghum at 2 angstroms resolution
Descriptor: DI(HYDROXYETHYL)ETHER, GLYCEROL, Malic enzyme, ...
Authors:Trajtenberg, F, Alvarez, C, Buschiazzo, A.
Deposit date:2018-01-23
Release date:2019-01-30
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2 Å)
Cite:Molecular adaptations of NADP-malic enzyme for its function in C4photosynthesis in grasses.
Nat.Plants, 5, 2019
6KDD
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BU of 6kdd by Molmil
endoglucanase
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Endoglucanase, GLYCEROL, ...
Authors:Yu, S, Liuqing, C.
Deposit date:2019-07-02
Release date:2020-07-08
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (1.92 Å)
Cite:crystal structure of an endoglucanase from Fervidobacterium pennivorans DSM9078
To Be Published
7E9W
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BU of 7e9w by Molmil
The Crystal Structure of D-psicose-3-epimerase from Biortus.
Descriptor: D-psicose 3-epimerase, GLYCEROL, MANGANESE (II) ION
Authors:Wang, F, Xu, C, Qi, J, Zhang, M, Tian, F, Wang, M.
Deposit date:2021-03-05
Release date:2021-03-24
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:The Crystal Structure of D-psicose-3-epimerase from Biortus.
To Be Published
2L2X
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BU of 2l2x by Molmil
Thiostrepton, oxidized at CA-CB bond of residue 9
Descriptor: Thiostrepton
Authors:Jonker, H.R.A, Baumann, S, Wolf, A, Schoof, S, Hiller, F, Schulte, K.W, Kirschner, K.N, Schwalbe, H, Arndt, H.-D.
Deposit date:2010-08-27
Release date:2011-02-02
Last modified:2013-06-26
Method:SOLUTION NMR
Cite:NMR structures of thiostrepton derivatives for characterization of the ribosomal binding site.
Angew.Chem.Int.Ed.Engl., 50, 2011
4TWS
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BU of 4tws by Molmil
Gadolinium Derivative of Tetragonal Hen Egg-White Lysozyme at 1.45 A Resolution
Descriptor: 10-((2R)-2-HYDROXYPROPYL)-1,4,7,10-TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID, CHLORIDE ION, GADOLINIUM ATOM, ...
Authors:Holton, J.M, Classen, S, Frankel, K.A, Tainer, J.A.
Deposit date:2014-07-01
Release date:2014-08-20
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:The R-factor gap in macromolecular crystallography: an untapped potential for insights on accurate structures.
Febs J., 281, 2014
3RHH
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BU of 3rhh by Molmil
Crystal structure of NADP-dependent glyceraldehyde-3-phosphate dehydrogenase from Bacillus halodurans C-125 complexed with NADP
Descriptor: NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, NADP-dependent glyceraldehyde-3-phosphate dehydrogenase, SULFATE ION
Authors:Malashkevich, V.N, Toro, R, Seidel, R, Garrett, S, Foti, R, Almo, S.C, New York Structural Genomics Research Consortium (NYSGRC)
Deposit date:2011-04-11
Release date:2011-05-18
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structure of NADP-dependent glyceraldehyde-3-phosphate dehydrogenase from Bacillus halodurans C-125 complexed with NADP
To be Published
1RRL
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BU of 1rrl by Molmil
Soybean Lipoxygenase (LOX-3) at 93K at 2.0 A resolution
Descriptor: FE (II) ION, Seed lipoxygenase-3
Authors:Borbulevych, O.Y, Jankun, J, Skrzypczak-Jankun, E.
Deposit date:2003-12-08
Release date:2004-12-21
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:Effect of crystal freezing and small-molecule binding on internal cavity size in a large protein: X-ray and docking studies of lipoxygenase at ambient and low temperature at 2.0 A resolution.
Acta Crystallogr.,Sect.D, 62, 2006
3RI8
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BU of 3ri8 by Molmil
Xylanase C from Aspergillus kawachii D37N mutant
Descriptor: Endo-1,4-beta-xylanase 3
Authors:Fushinobu, S, Uno, T, Kitaoka, M, Hayashi, K, Matsuzawa, H, Wakagi, T.
Deposit date:2011-04-13
Release date:2011-10-12
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2 Å)
Cite:Mutational analysis of fungal family 11 xylanases on pH optimum determination
J.APPL.GLYOSCI., 58, 2011
3RHD
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BU of 3rhd by Molmil
Crystal structure of glyceraldehyde-3-phosphate dehydrogenase GapN from Methanocaldococcus jannaschii DSM 2661 complexed with NADP
Descriptor: Lactaldehyde dehydrogenase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Malashkevich, V.N, Toro, R, Seidel, R, Garrett, S, Foti, R, Almo, S.C, New York Structural Genomics Research Consortium (NYSGRC)
Deposit date:2011-04-11
Release date:2011-05-18
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Crystal structure of glyceraldehyde-3-phosphate dehydrogenase GapN from Methanocaldococcus jannaschii DSM 2661 complexed with NADP
To be Published
3RIT
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BU of 3rit by Molmil
Crystal structure of Dipeptide Epimerase from Methylococcus capsulatus complexed with Mg and dipeptide L-Arg-D-Lys
Descriptor: ARGININE, D-LYSINE, Dipeptide epimerase, ...
Authors:Lukk, T, Sakai, A, Song, L, Gerlt, J.A, Nair, S.K.
Deposit date:2011-04-14
Release date:2011-04-27
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.701 Å)
Cite:Homology models guide discovery of diverse enzyme specificities among dipeptide epimerases in the enolase superfamily.
Proc.Natl.Acad.Sci.USA, 109, 2012
3RIL
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BU of 3ril by Molmil
The acid beta-glucosidase active site exhibits plasticity in binding 3,4,5,6-tetrahydroxyazepane-based inhibitors: implications for pharmacological chaperone design for gaucher disease
Descriptor: (3S,4R,5R,6S)-azepane-3,4,5,6-tetrol, 2-acetamido-2-deoxy-beta-D-glucopyranose, Glucosylceramidase, ...
Authors:Orwig, S.D, Lieberman, R.L.
Deposit date:2011-04-13
Release date:2012-03-14
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Binding of 3,4,5,6-tetrahydroxyazepanes to the acid-beta-glucosidase active site: implications for pharmacological chaperone design for Gaucher disease
Biochemistry, 50, 2011
8A5X
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BU of 8a5x by Molmil
Crystal structure of phosphatidyl inositol 4-kinase II beta in complex with MM1373
Descriptor: 4-azanyl-7-[3-(hydroxymethyl)phenyl]quinazoline-6-carboxamide, Phosphatidylinositol 4-kinase type 2-beta,Endolysin
Authors:Klima, M, Boura, E.
Deposit date:2022-06-16
Release date:2022-10-05
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structure-based design and modular synthesis of novel PI4K class II inhibitors bearing a 4-aminoquinazoline scaffold.
Bioorg.Med.Chem.Lett., 76, 2022
6KJ5
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BU of 6kj5 by Molmil
Crystal structure of 10-Hydroxygeraniol Dehydrogenase apo form from Cantharanthus roseus
Descriptor: 10-hydroxygeraniol dehydrogenase, ZINC ION
Authors:Sandholu, A.S, Sharmila, P.M, Thulasiram, H.V, Kulkarni, K.A.
Deposit date:2019-07-21
Release date:2020-03-25
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (3.75 Å)
Cite:Structural studies on 10-hydroxygeraniol dehydrogenase: A novel linear substrate-specific dehydrogenase from Catharanthus roseus.
Proteins, 88, 2020
7ECR
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BU of 7ecr by Molmil
Crystal Structure of Aspergillus terreus Glutamate Dehydrogenase (AtGDH) Complexed With Succinate and ADP-ribose
Descriptor: GLYCEROL, Glutamate dehydrogenase, SUCCINIC ACID, ...
Authors:Godsora, B.K.J, Prakash, P, Punekar, N.S, Bhaumik, P.
Deposit date:2021-03-13
Release date:2021-12-08
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.73 Å)
Cite:Molecular insights into the inhibition of glutamate dehydrogenase by the dicarboxylic acid metabolites.
Proteins, 90, 2022
4UBP
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BU of 4ubp by Molmil
STRUCTURE OF BACILLUS PASTEURII UREASE INHIBITED WITH ACETOHYDROXAMIC ACID AT 1.55 A RESOLUTION
Descriptor: ACETOHYDROXAMIC ACID, NICKEL (II) ION, PROTEIN (UREASE (CHAIN A)), ...
Authors:Benini, S, Rypniewski, W.R, Wilson, K.S, Ciurli, S, Mangani, S.
Deposit date:1999-02-25
Release date:2000-03-06
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:The complex of Bacillus pasteurii urease with acetohydroxamate anion from X-ray data at 1.55 A resolution.
J.Biol.Inorg.Chem., 5, 2000
5YWL
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BU of 5ywl by Molmil
SsCR_L211H
Descriptor: Protein induced by osmotic stress
Authors:Shang, Y.P, Chen, Q, Li, A.T, Yu, H.L, Xu, J.H.
Deposit date:2017-11-29
Release date:2019-03-06
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (2.098 Å)
Cite:Attenuated substrate inhibition of a haloketone reductase via structure-guided loop engineering.
J.Biotechnol., 308, 2020
2W43
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BU of 2w43 by Molmil
Structure of L-haloacid dehalogenase from S. tokodaii
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, HYPOTHETICAL 2-HALOALKANOIC ACID DEHALOGENASE, PHOSPHATE ION
Authors:Rye, C.A, Isupov, M.N, Lebedev, A.A, Littlechild, J.A.
Deposit date:2008-11-21
Release date:2008-12-09
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.66 Å)
Cite:Biochemical and Structural Studies of a L-Haloacid Dehalogenase from the Thermophilic Archaeon Sulfolobus Tokodaii.
Extremophiles, 13, 2009

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