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1H6I
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BU of 1h6i by Molmil
A REFINED STRUCTURE OF HUMAN AQUAPORIN 1
分子名称: AQUAPORIN-1
著者De Groot, B.L, Engel, A, Grubmuller, H.
登録日2001-06-15
公開日2001-12-13
最終更新日2024-05-01
実験手法ELECTRON CRYSTALLOGRAPHY (3.54 Å)
主引用文献A Refined Structure of Human Aquaporin 1
FEBS Lett., 504, 2001
4WU7
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BU of 4wu7 by Molmil
HLA-A24 in complex with HIV-1 Nef134-8(2F)
分子名称: 8-Mer peptide from Protein Nef, Beta-2-microglobulin, HLA class I histocompatibility antigen, ...
著者Shimizu, A, Yamagata, A, Fukai, S, Iwamoto, A.
登録日2014-10-31
公開日2015-05-06
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.297 Å)
主引用文献Crystal structure of Nef134-8 epitope presented by HLA-A24
To Be Published
4M9D
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BU of 4m9d by Molmil
The Crystal structure of an adenylosuccinate synthetase from Bacillus anthracis str. Ames Ancestor in complex with AMP.
分子名称: 1,2-ETHANEDIOL, ADENOSINE MONOPHOSPHATE, Adenylosuccinate synthetase, ...
著者Tan, K, Zhou, M, Kwon, K, Anderson, W.F, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID)
登録日2013-08-14
公開日2013-08-28
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (1.821 Å)
主引用文献The Crystal structure of an adenylosuccinate synthetase from Bacillus anthracis str. Ames Ancestor in complex with AMP.
To be Published
4MAU
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BU of 4mau by Molmil
Crystal structure of anti-ST2L antibody C2244
分子名称: C2244 heavy chain, C2244 light chain, FORMIC ACID, ...
著者Teplyakov, A, Obmolova, G, Malia, T, Gilliland, G.L.
登録日2013-08-16
公開日2014-03-26
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Antibody modeling assessment II. Structures and models.
Proteins, 82, 2014
6FKW
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BU of 6fkw by Molmil
Europium-containing methanol dehydrogenase
分子名称: EUROPIUM ION, Methanol dehydrogenase, PYRROLOQUINOLINE QUINONE
著者Barends, T, Dietl, A.
登録日2018-01-24
公開日2018-03-21
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Similar but not the same: First Kinetic and Structural Analyses of a Methanol Dehydrogenase Containing a Europium Ion in the Active Site.
Chembiochem, 2018
4M6A
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BU of 4m6a by Molmil
N-Terminal beta-Strand Swapping in a Consensus Derived Alternative Scaffold Driven by Stabilizing Hydrophobic Interactions
分子名称: Tencon
著者Luo, J, Teplyakov, A, Obmolova, G, Malia, T.J, Chan, W, Jocobs, S.A, O'neil, K.T, Gilliland, G.L.
登録日2013-08-09
公開日2014-02-26
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.71 Å)
主引用文献N-terminal beta-strand swapping in a consensus-derived alternative scaffold driven by stabilizing hydrophobic interactions.
Proteins, 82, 2014
4M6O
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BU of 4m6o by Molmil
Crystal structure of anti-NGF antibody CNTO7309
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CNTO7309 heavy chain, CNTO7309 light chain, ...
著者Teplyakov, A, Obmolova, G, Malia, T, Gilliland, G.L.
登録日2013-08-09
公開日2014-03-26
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Antibody modeling assessment II. Structures and models.
Proteins, 82, 2014
4MDE
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BU of 4mde by Molmil
Structure of bacterial polynucleotide kinase product complex bound to GDP and DNA
分子名称: DNA (5'-D(P*CP*CP*TP*GP*T)-3'), GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
著者Shuman, S, Das, U, Wang, L.K, Smith, P, Jacewicz, A.
登録日2013-08-22
公開日2013-11-06
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structures of bacterial polynucleotide kinase in a Michaelis complex with GTP*Mg2+ and 5'-OH oligonucleotide and a product complex with GDP*Mg2+ and 5'-PO4 oligonucleotide reveal a mechanism of general acid-base catalysis and the determinants of phosphoacceptor recognition.
Nucleic Acids Res., 42, 2014
6F06
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CATHEPSIN L IN COMPLEX WITH (3S,14E)-8-(azetidin-3-yl)-19-chloro-N-(1-cyanocyclopropyl)-5-oxo-12,17-dioxa-4-azatricyclo[16.2.2.06,11]docosa-1(21),6,8,10,14,18(22),19-heptaene-3-carboxamide
分子名称: (3~{S},14~{E})-8-(azetidin-3-yl)-19-chloranyl-~{N}-(1-cyanocyclopropyl)-5-oxidanylidene-12,17-dioxa-4-azatricyclo[16.2.2.0^{6,11}]docosa-1(21),6(11),7,9,14,18(22),19-heptaene-3-carboxamide, CHLORIDE ION, Cathepsin L1, ...
著者Kuglstatter, A, Stihle, M.
登録日2017-11-17
公開日2018-04-11
最終更新日2018-05-09
実験手法X-RAY DIFFRACTION (2.02 Å)
主引用文献Repurposing a Library of Human Cathepsin L Ligands: Identification of Macrocyclic Lactams as Potent Rhodesain and Trypanosoma brucei Inhibitors.
J. Med. Chem., 61, 2018
6EVU
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BU of 6evu by Molmil
Adhesin domain of PrgB from Enterococcus faecalis
分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, PHOSPHATE ION, PrgB
著者Schmitt, A, Berntsson, R.P.A.
登録日2017-11-02
公開日2018-05-16
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.598 Å)
主引用文献PrgB promotes aggregation, biofilm formation, and conjugation through DNA binding and compaction.
Mol. Microbiol., 109, 2018
4MGV
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BU of 4mgv by Molmil
Crystal structure of FK506 binding domain of plasmodium VIVAX FKBP35 In complex with inhibitor D5
分子名称: 70 kDa peptidylprolyl isomerase, putative, N'-(1-adamantylcarbonyl)pyridine-4-carbohydrazide
著者Rajan, S, Harikishore, A, Yoon, H.S.
登録日2013-08-29
公開日2013-12-04
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.72 Å)
主引用文献Adamantyl derivative as a potent inhibitor of Plasmodium FK506 binding protein 35.
Acs Med.Chem.Lett., 4, 2013
6F20
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Complex between MTH1 and compound 1 (a 7-azaindole-4-ester derivative)
分子名称: 7,8-dihydro-8-oxoguanine triphosphatase, ACETATE ION, Ethyl 1H-pyrrolo[2,3-b]pyridine-4-carboxylate, ...
著者Viklund, J, Talagas, A, Tresaugues, L, Andersson, M, Ericsson, U, Forsblom, R, Ginman, T, Hallberg, K, Lindstrom, J, Persson, L, Silvander, C, Rahm, F.
登録日2017-11-23
公開日2018-03-07
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Creation of a Novel Class of Potent and Selective MutT Homologue 1 (MTH1) Inhibitors Using Fragment-Based Screening and Structure-Based Drug Design.
J. Med. Chem., 61, 2018
4LO8
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BU of 4lo8 by Molmil
HA70(D3)-HA17
分子名称: HA-17, HA-70
著者Lee, K, Gu, S, Jin, L, Le, T.T, Cheng, L.W, Strotmeier, J, Kruel, A.M, Yao, G, Perry, K, Rummel, A, Jin, R.
登録日2013-07-12
公開日2013-10-30
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structure of a Bimodular Botulinum Neurotoxin Complex Provides Insights into Its Oral Toxicity.
Plos Pathog., 9, 2013
4LQB
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BU of 4lqb by Molmil
Crystal structure of uncharacterized protein Kfla3161
分子名称: CITRIC ACID, GLYCEROL, Uncharacterized protein
著者Chang, C, Chhor, G, Endres, M, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2013-07-17
公開日2013-07-31
最終更新日2017-11-15
実験手法X-RAY DIFFRACTION (1.72 Å)
主引用文献Crystal structure of uncharacterized protein Kfla3161
To be Published
4LQQ
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Crystal structure of the Cbk1(T743E)-Mob2 kinase-coactivator complex in crystal form B
分子名称: CBK1 kinase activator protein MOB2, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, Serine/threonine-protein kinase CBK1
著者Gogl, G, Remenyi, A.
登録日2013-07-19
公開日2014-07-30
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (3.6 Å)
主引用文献The Structure of an NDR/LATS Kinase-Mob Complex Reveals a Novel Kinase-Coactivator System and Substrate Docking Mechanism.
Plos Biol., 13, 2015
4LUF
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BU of 4luf by Molmil
Crystal Structure of Ovine Serum Albumin
分子名称: (2R)-2-{[(2R)-2-{[(2S)-2-{[(2R)-2-hydroxypropyl]oxy}propyl]oxy}propyl]oxy}propan-1-ol, (2S)-2-hydroxybutanedioic acid, ACETATE ION, ...
著者Bujacz, A, Talaj, J.A, Pietrzyk, A.J, Bujacz, G.
登録日2013-07-25
公開日2014-09-17
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Crystal structure of ovine serum albumin and its complex with 3,5-diiodosalicylic acid
To be Published
4M48
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BU of 4m48 by Molmil
X-ray structure of dopamine transporter elucidates antidepressant mechanism
分子名称: 9D5 antibody, heavy chain, light chain, ...
著者Gouaux, E, Penmatsa, A, Wang, K.
登録日2013-08-06
公開日2013-09-18
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.955 Å)
主引用文献X-ray structure of dopamine transporter elucidates antidepressant mechanism.
Nature, 503, 2013
4M1D
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Crystal structure of anti-HIV-1 Fab 447-52D in complex with V3 cyclic peptide MN
分子名称: Cyclic V3 Arch Peptide, Fab mAb 447-52D Heavy Chain, Fab mAb 447-52D Light Chain, ...
著者Killikelly, A, Kong, X.P.
登録日2013-08-02
公開日2013-09-04
最終更新日2013-12-25
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Thermodynamic Signatures of the Antigen Binding Site of mAb 447-52D Targeting the Third Variable Region of HIV-1 gp120.
Biochemistry, 52, 2013
4MA9
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BU of 4ma9 by Molmil
Wild type Salmonella Alkyl Hydroperoxide Reductase C in its substrate-ready conformation
分子名称: Alkyl hydroperoxide reductase subunit C, CHLORIDE ION, GLYCEROL, ...
著者Perkins, A, Karplus, P.A.
登録日2013-08-15
公開日2013-11-20
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.82 Å)
主引用文献The sensitive balance between the fully folded and locally unfolded conformations of a model peroxiredoxin.
Biochemistry, 52, 2013
4M7K
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Crystal structure of anti-tissue factor antibody 10H10
分子名称: 10H10 heavy chain, 10H10 light chain, ACETATE ION, ...
著者Teplyakov, A, Obmolova, G, Malia, T, Gilliland, G.L.
登録日2013-08-12
公開日2014-03-26
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Antibody modeling assessment II. Structures and models.
Proteins, 82, 2014
4M88
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Crystal structure of extracellular ligand-binding receptor from Verminephrobacter eiseniae ef01-2
分子名称: Extracellular ligand-binding receptor, GLYCEROL
著者Wu, R, Endres, M, Joachimiak, A, Midwest Center for Structural Genomics, Midwest Center for Structural Genomics (MCSG)
登録日2013-08-13
公開日2013-11-06
最終更新日2018-01-24
実験手法X-RAY DIFFRACTION (1.762 Å)
主引用文献Crystal structure of extracellular ligand-binding receptor from Verminephrobacter eiseniae ef01-2
To be Published
4MD8
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Crystal Structure of full-length symmetric CK2 holoenzyme with mutated alpha subunit (F121E)
分子名称: Casein kinase II subunit alpha, Casein kinase II subunit beta, ZINC ION
著者Lolli, G, Ranchio, A, Battistutta, R.
登録日2013-08-22
公開日2013-11-20
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (3.3 Å)
主引用文献Active Form of the Protein Kinase CK2 alpha 2 beta 2 Holoenzyme Is a Strong Complex with Symmetric Architecture.
Acs Chem.Biol., 9, 2014
6FFB
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17beta-hydroxysteroid dehydrogenase 14 variant S205 - mutant Q148A - in complex with a nonsteroidal inhibitor
分子名称: 17-beta-hydroxysteroid dehydrogenase 14, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, SODIUM ION, ...
著者Bertoletti, N, Heine, A, Klebe, G, Marchais-Oberwinkler, S.
登録日2018-01-05
公開日2019-01-30
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Mutational and structural studies uncover crucial amino acids determining activity and stability of 17 beta-HSD14.
J.Steroid Biochem.Mol.Biol., 189, 2019
4MA3
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Crystal structure of anti-hinge rabbit antibody C2095
分子名称: ACETATE ION, C2095 heavy chain, C2095 light chain, ...
著者Malia, T, Teplyakov, A, Gilliland, G.L.
登録日2013-08-15
公開日2014-03-26
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structure and specificity of an antibody targeting a proteolytically cleaved IgG hinge.
Proteins, 82, 2014
6F4D
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Structure of the Y21F variant of quinolinate synthase in complex with PGH
分子名称: CHLORIDE ION, IRON/SULFUR CLUSTER, PHOSPHATE ION, ...
著者Volbeda, A, Fontecilla-Camps, J.C.
登録日2017-11-29
公開日2018-04-25
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Crystallographic Trapping of Reaction Intermediates in Quinolinic Acid Synthesis by NadA.
ACS Chem. Biol., 13, 2018

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