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2RDT
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BU of 2rdt by Molmil
Crystal Structure of Human Glycolate Oxidase (GO) in Complex with CDST
分子名称: 5-(dodecylthio)-1H-1,2,3-triazole-4-carboxylic acid, FLAVIN MONONUCLEOTIDE, Hydroxyacid oxidase 1
著者Murray, M.S, Holmes, R.P, Lowther, W.T.
登録日2007-09-25
公開日2008-02-26
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Active Site and Loop 4 Movements within Human Glycolate Oxidase: Implications for Substrate Specificity and Drug Design.
Biochemistry, 47, 2008
4Q39
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BU of 4q39 by Molmil
PylD in complex with pyrrolysine and NADH
分子名称: 1,2-ETHANEDIOL, 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, DI(HYDROXYETHYL)ETHER, ...
著者Quitterer, F, Beck, P, Bacher, A, Groll, M.
登録日2014-04-11
公開日2014-04-23
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献The Formation of Pyrroline and Tetrahydropyridine Rings in Amino Acids Catalyzed by Pyrrolysine Synthase (PylD).
Angew.Chem.Int.Ed.Engl., 53, 2014
2RBW
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BU of 2rbw by Molmil
Cytochrome C Peroxidase W191G in complex with 1,2-dimethyl-1h-pyridin-5-amine
分子名称: 5-amino-1,2-dimethylpyridinium, Cytochrome C Peroxidase, PHOSPHATE ION, ...
著者Graves, A.P, Boyce, S.E, Shoichet, B.K.
登録日2007-09-19
公開日2008-03-18
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Rescoring docking hit lists for model cavity sites: predictions and experimental testing.
J.Mol.Biol., 377, 2008
3CV6
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BU of 3cv6 by Molmil
The crystal structure of mouse 17-alpha hydroxysteroid dehydrogenase GG225.226PP mutant in complex with inhibitor and cofactor NADP+.
分子名称: 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol, Aldo-keto reductase family 1 member C21, BETA-MERCAPTOETHANOL, ...
著者Dhagat, U, El-Kabbani, O.
登録日2008-04-17
公開日2009-03-03
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structure of the G225P/G226P mutant of mouse 3(17)alpha-hydroxysteroid dehydrogenase (AKR1C21) ternary complex: implications for the binding of inhibitor and substrate.
Acta Crystallogr.,Sect.D, 65, 2009
4NBV
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BU of 4nbv by Molmil
Crystal structure of FabG from Cupriavidus taiwanensis
分子名称: 2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 3-oxoacyl-[acyl-carrier-protein] reductase putative short-chain dehydrogenases/reductases (SDR) family protein
著者Pereira, J.H, Mcandrew, R.P, Javidpour, P, Beller, H.R, Adams, P.D.
登録日2013-10-23
公開日2013-12-04
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.645 Å)
主引用文献Biochemical and Structural Studies of NADH-Dependent FabG Used To Increase the Bacterial Production of Fatty Acids under Anaerobic Conditions.
Appl.Environ.Microbiol., 80, 2014
1BU7
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BU of 1bu7 by Molmil
CRYOGENIC STRUCTURE OF CYTOCHROME P450BM-3 HEME DOMAIN
分子名称: 1,2-ETHANEDIOL, PROTEIN (CYTOCHROME P450), PROTOPORPHYRIN IX CONTAINING FE
著者Li, H, Poulos, T.L.
登録日1998-09-14
公開日1998-09-23
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Structure of a cytochrome P450-redox partner electron-transfer complex.
Proc.Natl.Acad.Sci.USA, 96, 1999
1T7Q
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BU of 1t7q by Molmil
Crystal structure of the F565A mutant of murine carnitine acetyltransferase in complex with carnitine and CoA
分子名称: 1,2-ETHANEDIOL, CARNITINE, COENZYME A, ...
著者Hsiao, Y.-S, Jogl, G, Tong, L.
登録日2004-05-10
公開日2004-06-22
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structural and biochemical studies of the substrate selectivity of carnitine acetyltransferase
J.Biol.Chem., 279, 2004
5AC2
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BU of 5ac2 by Molmil
human aldehyde dehydrogenase 1A1 with duocarmycin analog
分子名称: 1-[(1S)-1-methyl-5-oxidanyl-1,2-dihydrobenzo[e]indol-3-yl]hexan-1-one, RETINAL DEHYDROGENASE 1, YTTERBIUM (III) ION, ...
著者Koch, M.F, Harteis, S, Blank, I.D, Pestel, G, Tietze, L.F, Ochsenfeld, C, Schneider, S, Sieber, S.A.
登録日2015-08-11
公開日2015-08-26
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Structural, Biochemical, and Computational Studies Reveal the Mechanism of Selective Aldehyde Dehydrogenase 1A1 Inhibition by Cytotoxic Duocarmycin Analogues.
Angew.Chem.Int.Ed.Engl., 54, 2015
4IIU
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BU of 4iiu by Molmil
Crystal structure of a putative 3-oxoacyl-[acyl-carrier protein]reductase from Escherichia coli strain CFT073 complexed with NADP+ at 2.1 A resolution
分子名称: 3-oxoacyl-[acyl-carrier protein] reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
著者Hou, J, Osinski, T, Zheng, H, Shumilin, I, Shabalin, I, Shatsman, S, Anderson, W.F, Minor, W, Center for Structural Genomics of Infectious Diseases (CSGID)
登録日2012-12-20
公開日2013-01-09
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Crystal structure of a putative 3-oxoacyl-[acyl-carrier protein]reductase from Escherichia coli strain CFT073 complexed with NADP+ at 2.1 A resolution
To be Published
3RPE
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BU of 3rpe by Molmil
1.1 Angstrom Crystal Structure of Putative Modulator of Drug Activity (MdaB) from Yersinia pestis CO92.
分子名称: DI(HYDROXYETHYL)ETHER, FLAVIN-ADENINE DINUCLEOTIDE, Modulator of drug activity B
著者Minasov, G, Halavaty, A, Shuvalova, L, Dubrovska, I, Winsor, J, Papazisi, L, Anderson, W.F, Center for Structural Genomics of Infectious Diseases (CSGID)
登録日2011-04-26
公開日2011-05-04
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.1 Å)
主引用文献1.1 Angstrom Crystal Structure of Putative Modulator of Drug Activity (MdaB) from Yersinia pestis CO92.
TO BE PUBLISHED
7F4V
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BU of 7f4v by Molmil
Cryo-EM structure of a primordial cyanobacterial photosystem I
分子名称: 1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLE, 1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDE, BETA-CAROTENE, ...
著者Kato, K, Hamaguchi, T, Nagao, R, Kawakami, K, Yonekura, K, Shen, J.R.
登録日2021-06-21
公開日2022-04-06
最終更新日2024-10-16
実験手法ELECTRON MICROSCOPY (2.04 Å)
主引用文献Structural basis for the absence of low-energy chlorophylls responsible for photoprotection from a primitive cyanobacterial PSI
Biorxiv, 2022
5DKG
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BU of 5dkg by Molmil
Crystal Structure of the ER-alpha Ligand-binding Domain in complex with a t-butyl-substituted, methyl, triaryl-ethylene derivative 4,4'-[2-(4-tert-butylphenyl)prop-1-ene-1,1-diyl]diphenol
分子名称: 4,4'-[2-(4-tert-butylphenyl)prop-1-ene-1,1-diyl]diphenol, Estrogen receptor, Nuclear receptor coactivator 2
著者Nwachukwu, J.C, Srinivasan, S, Zheng, Y, Wang, S, Min, J, Dong, C, Liao, Z, Cavett, V, Nowak, J, Houtman, R, Carlson, K.E, Josan, J.S, Elemento, O, Katzenellenbogen, J.A, Zhou, H.B, Nettles, K.W.
登録日2015-09-03
公開日2016-05-04
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Predictive features of ligand-specific signaling through the estrogen receptor.
Mol.Syst.Biol., 12, 2016
2BL7
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BU of 2bl7 by Molmil
1.6 Angstrom crystal structure of EntA-im: a bacterial immunity protein conferring immunity to the antimicrobial activity of the pediocin-like bacteriocin, enterocin A
分子名称: ENTEROCINE A IMMUNITY PROTEIN
著者Johnsen, L, Dalhus, B, Leiros, I, Nissen-Meyer, J.
登録日2005-03-02
公開日2005-03-07
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献1.6-A Crystal Structure of Enta-Im: A Bacterial Immunity Protein Conferring Immunity to the Antimicrobial Activity of the Pediocin-Like Bacteriocin Enterocin A
J.Biol.Chem., 280, 2005
3N8M
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BU of 3n8m by Molmil
Crystal Structure of the Grb2 SH2 Domain in Complex with An Acyclic Ligand Having the Sequence pYVNVP
分子名称: GLYCEROL, Growth factor receptor-bound protein 2, PEPTIDE
著者Whiddon, B.B, Clements, J.H, Martin, S.F.
登録日2010-05-28
公開日2010-12-15
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Thermodynamic and Structural Effects of Macrocyclization as a Constraining Method in Protein-Ligand Interactions.
ACS MED.CHEM.LETT., 1, 2010
3I1J
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BU of 3i1j by Molmil
Structure of a putative short chain dehydrogenase from Pseudomonas syringae
分子名称: 1,2-ETHANEDIOL, ACETATE ION, CHLORIDE ION, ...
著者Singer, A.U, Evdokimova, E, Kudritska, M, Edwards, A.M, Joachimiak, A, Savchenko, A, Midwest Center for Structural Genomics (MCSG)
登録日2009-06-26
公開日2009-07-14
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structure of a putative short chain dehydrogenase from Pseudomonas syringae
To be Published
5E70
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BU of 5e70 by Molmil
Crystal structure of Ecoli Branching Enzyme with gamma cyclodextrin
分子名称: 1,4-alpha-glucan branching enzyme GlgB, Cyclooctakis-(1-4)-(alpha-D-glucopyranose), GLYCEROL
著者Feng, L, Nosrati, M, Geiger, J.H.
登録日2015-10-11
公開日2015-12-16
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.33 Å)
主引用文献Crystal structures of Escherichia coli branching enzyme in complex with cyclodextrins.
Acta Crystallogr D Struct Biol, 72, 2016
5E6Z
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BU of 5e6z by Molmil
Crystal structure of Ecoli Branching Enzyme with beta cyclodextrin
分子名称: 1,4-alpha-glucan branching enzyme GlgB, Cycloheptakis-(1-4)-(alpha-D-glucopyranose), GLYCEROL
著者Feng, L, Nosrati, M, Geiger, J.H.
登録日2015-10-11
公開日2015-12-16
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.878 Å)
主引用文献Crystal structures of Escherichia coli branching enzyme in complex with cyclodextrins.
Acta Crystallogr D Struct Biol, 72, 2016
2BL8
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BU of 2bl8 by Molmil
1.6 Angstrom crystal structure of EntA-im: a bacterial immunity protein conferring immunity to the antimicrobial activity of the pediocin-like bacteriocin, enterocin A
分子名称: CITRATE ANION, ENTEROCINE A IMMUNITY PROTEIN
著者Johnsen, L, Dalhus, B, Leiros, I, Nissen-Meyer, J.
登録日2005-03-02
公開日2005-03-07
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献1.6-A Crystal Structure of Enta-Im: A Bacterial Immunity Protein Conferring Immunity to the Antimicrobial Activity of the Pediocin-Like Bacteriocin Enterocin A
J.Biol.Chem., 280, 2005
1O76
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CYANIDE COMPLEX OF P450CAM FROM PSEUDOMONAS PUTIDA
分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CAMPHOR, CYANIDE ION, ...
著者Fedorov, R, Ghosh, D, Schlichting, I.
登録日2002-10-23
公開日2002-12-19
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal Structures of Cyanide Complexes of P450Cam and the Oxygenase Domain of Inducible Nitric Oxide Synthase-Structural Models of the Short-Lived Oxygen Complexes
Arch.Biochem.Biophys., 409, 2003
6EV2
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BU of 6ev2 by Molmil
Crystal structure of antibody against schizophyllan in complex with laminarihexaose
分子名称: Heavy chain, Light chain, beta-D-glucopyranose, ...
著者Sung, K.H, Josewski, J, Duebel, S, Blankenfeldt, W, Rau, U.
登録日2017-11-01
公開日2018-09-26
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (2.403 Å)
主引用文献Structural insights into antigen recognition of an anti-beta-(1,6)-beta-(1,3)-D-glucan antibody.
Sci Rep, 8, 2018
5E6Y
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BU of 5e6y by Molmil
Crystal structure of E.Coli branching enzyme in complex with alpha cyclodextrin
分子名称: 1,4-alpha-glucan branching enzyme GlgB, Cyclohexakis-(1-4)-(alpha-D-glucopyranose), GLYCEROL
著者Feng, L, Nosrati, M, Geiger, J.H.
登録日2015-10-11
公開日2015-12-16
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Crystal structures of Escherichia coli branching enzyme in complex with cyclodextrins.
Acta Crystallogr D Struct Biol, 72, 2016
1AMM
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BU of 1amm by Molmil
1.2 ANGSTROM STRUCTURE OF GAMMA-B CRYSTALLIN AT 150K
分子名称: GAMMA B-CRYSTALLIN
著者Kumaraswamy, V.S, Lindley, P.F, Slingsby, C, Glover, I.D.
登録日1996-03-20
公開日1996-11-08
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.2 Å)
主引用文献An eye lens protein-water structure: 1.2 A resolution structure of gammaB-crystallin at 150 K.
Acta Crystallogr.,Sect.D, 52, 1996
1OAA
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MOUSE SEPIAPTERIN REDUCTASE COMPLEXED WITH NADP AND OXALOACETATE
分子名称: NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, OXALOACETATE ION, SEPIAPTERIN REDUCTASE, ...
著者Auerbach, G, Herrmann, A, Bacher, A, Huber, R.
登録日1997-08-25
公開日1999-02-16
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (1.25 Å)
主引用文献The 1.25 A crystal structure of sepiapterin reductase reveals its binding mode to pterins and brain neurotransmitters.
EMBO J., 16, 1997
4AP9
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BU of 4ap9 by Molmil
Crystal structure of phosphoserine phosphatase from T. onnurineus in complex with NDSB-201
分子名称: 3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE, PHOSPHOSERINE PHOSPHATASE
著者Jung, T.-Y, Kim, Y.-S, Song, H.-N, Woo, E.
登録日2012-03-31
公開日2012-12-26
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (1.783 Å)
主引用文献Identification of a Novel Ligand Binding Site in Phosphoserine Phosphatase from the Hyperthermophilic Archaeon Thermococcus Onnurineus.
Proteins, 81, 2013
5T0V
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Architecture of the Yeast Mitochondrial Iron-Sulfur Cluster Assembly Machinery: the Sub-Complex Formed by the Iron Donor, Yfh1, and the Scaffold, Isu1
分子名称: Frataxin homolog, mitochondrial, Iron sulfur cluster assembly protein 1
著者Ranatunga, W, Gakh, O, Galeano, B.K, Smith IV, D.Y, Soderberg, C.A, Al-Karadaghi, S, Thompson, J.R, Isaya, G.
登録日2016-08-16
公開日2016-08-31
最終更新日2024-10-09
実験手法ELECTRON MICROSCOPY (17.5 Å)
主引用文献Architecture of the Yeast Mitochondrial Iron-Sulfur Cluster Assembly Machinery: the Sub-Complex Formed by the Iron Donor, Yfh1, and the Scaffold, Isu1
J. Biol. Chem., 291, 2016

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