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8HMQ
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BU of 8hmq by Molmil
Crystal Structure of PKM2 mutant P403A
Descriptor: 1,2-ETHANEDIOL, 1,6-di-O-phosphono-beta-D-fructofuranose, GLYCEROL, ...
Authors:Upadhyay, S, Kumar, A, Patel, A.K.
Deposit date:2022-12-05
Release date:2023-01-11
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural and mechanistic insights into cancer patient-derived mutations in Pyruvate Kinase muscle isoform 2
To Be Published
8HMR
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BU of 8hmr by Molmil
Crystal Structure of PKM2 mutant L144P
Descriptor: 1,2-ETHANEDIOL, 1,6-di-O-phosphono-beta-D-fructofuranose, MAGNESIUM ION, ...
Authors:Upadhyay, S, Kumar, A, Patel, A.K.
Deposit date:2022-12-05
Release date:2023-01-11
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structural and mechanistic insights into cancer patient-derived mutations in Pyruvate Kinase muscle isoform 2
To Be Published
8HMU
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BU of 8hmu by Molmil
Crystal Structure of PKM2 mutant R516C
Descriptor: 1,2-ETHANEDIOL, 1,6-di-O-phosphono-beta-D-fructofuranose, GLYCEROL, ...
Authors:Upadhyay, S, Kumar, A, Patel, A.K.
Deposit date:2022-12-05
Release date:2023-01-11
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural and mechanistic insights into cancer patient-derived mutations in Pyruvate Kinase muscle isoform 2
To Be Published
1QL3
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BU of 1ql3 by Molmil
Structure of the soluble domain of cytochrome c552 from Paracoccus denitrificans in the reduced state
Descriptor: CYTOCHROME C552, HEME C
Authors:Harrenga, A, Reincke, B, Rueterjans, H, Ludwig, B, Michel, H.
Deposit date:1999-08-20
Release date:2000-02-06
Last modified:2019-07-24
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Structure of the Soluble Domain of Cytochrome C552 from Paracoccus Denitrificans in the Oxidized and Reduced States
J.Mol.Biol., 295, 2000
3BT7
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BU of 3bt7 by Molmil
Structure of E. coli 5-Methyluridine Methyltransferase TrmA in complex with 19 nucleotide T-arm analogue
Descriptor: RNA (5'-D(P*GP*CP*UP*GP*UP*GP*(5MU)P*UP*CP*GP*AP*UP*CP*CP*AP*CP*AP*GP*C)-3'), tRNA (uracil-5-)-methyltransferase
Authors:Alian, A, Stroud, R.M, Finer-Moore, J.
Deposit date:2007-12-27
Release date:2008-04-29
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.43 Å)
Cite:Structure of a TrmA-RNA complex: A consensus RNA fold contributes to substrate selectivity and catalysis in m5U methyltransferases.
Proc.Natl.Acad.Sci.Usa, 105, 2008
3BY6
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BU of 3by6 by Molmil
Crystal structure of a transcriptional regulator from Oenococcus oeni
Descriptor: CALCIUM ION, Predicted transcriptional regulator
Authors:Zhang, R, Volkart, L, Gu, M, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2008-01-15
Release date:2008-02-19
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:The crystal structure of a transcriptional regulator from Oenococcus oeni.
To be Published
1QR5
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BU of 1qr5 by Molmil
SOLUTION STRUCTURE OF HISTIDINE CONTAINING PROTEIN (HPR) FROM STAPHYLOCOCCUS CARNOSUS
Descriptor: PHOSPHOCARRIER PROTEIN HPR
Authors:Kalbitzer, H.R, Gorler, A, Li, H, Dubovskii, P.V, Hengstenberg, W, Kowolik, C, Yamada, H, Akasaka, K.
Deposit date:1999-05-19
Release date:2000-06-21
Last modified:2023-12-27
Method:SOLUTION NMR
Cite:15N and 1H NMR study of histidine containing protein (HPr) from Staphylococcus carnosus at high pressure.
Protein Sci., 9, 2000
1GON
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BU of 1gon by Molmil
b-glucosidase from Streptomyces sp
Descriptor: BETA-GLUCOSIDASE, MERCURY (II) ION, SULFATE ION
Authors:Guasch, A, Perez-Pons, J.A, Vallmitjana, M, Querol, E, Coll, M.
Deposit date:2001-10-22
Release date:2002-11-07
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Crystal Structure of a Family 1 Beta-Glucosidase from Streptomyces
To be Published
3C7F
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BU of 3c7f by Molmil
Crystal structure of a glycoside hydrolase family 43 arabinoxylan arabinofuranohydrolase from bacillus subtilis in complex with xylotriose.
Descriptor: CALCIUM ION, Endo-1,4-beta-xylanase, FORMIC ACID, ...
Authors:Vandermarliere, E, Bourgois, T.M, Winn, M.D, Van Campenhout, S, Volckaert, G, Strelkov, S.V, Delcour, J.A, Rabijns, A, Courtin, C.M.
Deposit date:2008-02-07
Release date:2008-11-18
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Structural analysis of a glycoside hydrolase family 43 arabinoxylan arabinofuranohydrolase in complex with xylotetraose reveals a different binding mechanism compared with other members of the same family.
Biochem.J., 418, 2009
1Q9H
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BU of 1q9h by Molmil
3-Dimensional structure of native Cel7A from Talaromyces emersonii
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, cellobiohydrolase I catalytic domain
Authors:Grassick, A, Thompson, R, Murray, P.G, Collins, C.M, Byrnes, L, Tuohy, M.G, Birrane, G, Higgins, T.M.
Deposit date:2003-08-25
Release date:2004-11-09
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Three-dimensional structure of a thermostable native cellobiohydrolase, CBH IB, and molecular characterization of the cel7 gene from the filamentous fungus, Talaromyces emersonii
Eur.J.Biochem., 271, 2004
8HHZ
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BU of 8hhz by Molmil
SARS-CoV-2 Omicron BA.1 Spike in complex with IY-2A
Descriptor: IY-2A Fab heavy chain, IY-2A Fab light chain, Spike glycoprotein
Authors:Chen, X, Mohapatra, A, Wu, Y.-M.
Deposit date:2022-11-17
Release date:2023-02-01
Method:ELECTRON MICROSCOPY (4.28 Å)
Cite:Structural basis for a conserved neutralization epitope on the receptor-binding domain of SARS-CoV-2.
Nat Commun, 14, 2023
3C8I
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BU of 3c8i by Molmil
Crystal structure of a putative membrane protein from Corynebacterium diphtheriae
Descriptor: Putative membrane protein
Authors:Zhang, R, Hatzos, C, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2008-02-12
Release date:2008-03-04
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:The crystal structure of a putative membrane protein from Corynebacterium diphtheriae.
To be Published
3C5I
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BU of 3c5i by Molmil
Crystal structure of Plasmodium knowlesi choline kinase, PKH_134520
Descriptor: CALCIUM ION, CHOLINE ION, Choline kinase, ...
Authors:Wernimont, A.K, Hills, T, Lew, J, Wasney, G, Senesterra, G, Kozieradzki, I, Cossar, D, Vedadi, M, Schapira, M, Bochkarev, A, Arrowsmith, C.H, Bountra, C, Weigelt, J, Edwards, A.M, Hui, R, Artz, J.D, Xiao, T, Structural Genomics Consortium (SGC)
Deposit date:2008-01-31
Release date:2008-02-19
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Crystal structure of Plasmodium knowlesi choline kinase, PKH_134520.
To be Published
8HHY
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BU of 8hhy by Molmil
SARS-CoV-2 Delta Spike in complex with IS-9A
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, IS-9A Fab heavy chain, ...
Authors:Mohapatra, A, Wu, Y.-M.
Deposit date:2022-11-17
Release date:2023-02-01
Method:ELECTRON MICROSCOPY (2.77 Å)
Cite:Structural basis for a conserved neutralization epitope on the receptor-binding domain of SARS-CoV-2.
Nat Commun, 14, 2023
3C75
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BU of 3c75 by Molmil
Paracoccus versutus methylamine dehydrogenase in complex with amicyanin
Descriptor: Amicyanin, COPPER (II) ION, Methylamine dehydrogenase heavy chain, ...
Authors:Cavalieri, C, Biermann, N, Vlasie, M.D, Einsle, O, Merli, A, Ferrari, D, Rossi, G.L, Ubbink, M.
Deposit date:2008-02-06
Release date:2008-12-30
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural comparison of crystal and solution states of the 138 kDa complex of methylamine dehydrogenase and amicyanin from Paracoccus versutus.
Biochemistry, 47, 2008
8HPK
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BU of 8hpk by Molmil
Crystal structure of the bacterial oxalate transporter OxlT in an oxalate-bound occluded form
Descriptor: Fab fragment Heavy chein, Fab fragment Light chain, OXALATE ION, ...
Authors:Shimamura, T, Hirai, T, Yamashita, A.
Deposit date:2022-12-12
Release date:2023-02-15
Last modified:2023-04-12
Method:X-RAY DIFFRACTION (3 Å)
Cite:Structure and mechanism of oxalate transporter OxlT in an oxalate-degrading bacterium in the gut microbiota.
Nat Commun, 14, 2023
3C87
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BU of 3c87 by Molmil
Crystal structure of the enterobactin esterase FES from Shigella flexneri in the presence of enterobactin
Descriptor: Enterochelin esterase, PHOSPHATE ION, SODIUM ION
Authors:Kim, Y, Maltseva, N, Abergel, R, Raymond, K, Holzle, D, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2008-02-11
Release date:2008-02-26
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.17 Å)
Cite:Siderophore Mediated Iron Acquisition: Structure and Specificity of Enterobactin Esterase from Shigella flexneri.
To be Published
8HPJ
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BU of 8hpj by Molmil
Crystal structure of the bacterial oxalate transporter OxlT in a ligand-free outward-facing form
Descriptor: Fv fragment Heavy chain, Fv fragment Light chain, Oxalate:formate antiporter
Authors:Shimamura, T, Hirai, T, Yamashita, A.
Deposit date:2022-12-12
Release date:2023-02-15
Last modified:2023-04-12
Method:X-RAY DIFFRACTION (3.3 Å)
Cite:Structure and mechanism of oxalate transporter OxlT in an oxalate-degrading bacterium in the gut microbiota.
Nat Commun, 14, 2023
1GPO
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BU of 1gpo by Molmil
CRYSTAL STRUCTURE OF THE RATIONALLY DESIGNED ANTIBODY M41 AS A FAB FRAGMENT
Descriptor: ANTIBODY M41, SULFATE ION
Authors:Schiweck, W, Skerra, A.
Deposit date:1997-03-27
Release date:1998-04-01
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:The rational construction of an antibody against cystatin: lessons from the crystal structure of an artificial Fab fragment.
J.Mol.Biol., 268, 1997
3BYA
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BU of 3bya by Molmil
Structure of a Calmodulin Complex
Descriptor: CALCIUM ION, Calmodulin, Glutamate [NMDA] receptor subunit zeta-1 peptide
Authors:Birrane, G, Soni, A, Ladias, J.A.A.
Deposit date:2008-01-15
Release date:2009-01-20
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Structure of a Calmodulin Complex
To be Published
1H5I
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BU of 1h5i by Molmil
X-ray induced reduction of horseradish peroxidase C1A Compound III (56-67% dose)
Descriptor: ACETATE ION, CALCIUM ION, HYDROGEN PEROXIDE, ...
Authors:Berglund, G.I, Carlsson, G.H, Hajdu, J, Smith, A.T, Szoke, H, Henriksen, A.
Deposit date:2001-05-22
Release date:2002-05-27
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:The Catalytic Pathway of Horseradish Peroxidase at High Resolution
Nature, 417, 2002
3BWL
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BU of 3bwl by Molmil
Crystal structure of PAS domain of HTR-like protein from Haloarcula marismortui
Descriptor: 1H-INDOLE-3-CARBALDEHYDE, MAGNESIUM ION, Sensor protein
Authors:Osipiuk, J, Zhou, M, Freeman, L, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2008-01-09
Release date:2008-01-15
Last modified:2017-10-25
Method:X-RAY DIFFRACTION (1.73 Å)
Cite:X-ray crystal structure of PAS domain of HTR-like protein from Haloarcula marismortui.
To be Published
8GZ7
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BU of 8gz7 by Molmil
Octahedral supramolecular assembly of the bicomponent gamma-hemolysin octameric pore complexes from Staphylococcus aureus Newman.
Descriptor: Gamma-hemolysin component A, Gamma-hemolysin component B
Authors:Mishra, S, Roy, A, Dutta, S.
Deposit date:2022-09-26
Release date:2023-03-22
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (3.5 Å)
Cite:Octahedral supramolecular assembly of the bicomponent gamma-hemolysin octameric pore complexes from Staphylococcus aureus Newman.
To Be Published
7AW0
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BU of 7aw0 by Molmil
MerTK kinase domain in complex with purine inhibitor
Descriptor: 2-(cyclopentyloxy)-9-(2,6-difluorobenzyl)-N-methyl-9H-purin-6-amine, Tyrosine-protein kinase Mer
Authors:Schimpl, M, Nissink, J.W.M, Blackett, C, Clarke, M, Disch, J, Goldberg, K, Guilinger, J, Hennessy, E.J, Jetson, R, Ginkunja, D, Hardaker, E, Keefe, A, McCoull, W, McMurray, L, Collingwood, O, Overman, R, Pflug, A, Preston, M, Rawlins, P, Rivers, E, Smith, P, Underwood, E, Truman, C, Warwicker, J, Winter, J, Woodcock, S, Zhang, Y.
Deposit date:2020-11-06
Release date:2021-03-03
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (1.893 Å)
Cite:Generating Selective Leads for Mer Kinase Inhibitors-Example of a Comprehensive Lead-Generation Strategy.
J.Med.Chem., 64, 2021
3BYH
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BU of 3byh by Molmil
Model of actin-fimbrin ABD2 complex
Descriptor: Actin, fimbrin ABD2
Authors:Galkin, V.E, Orlova, A, Cherepanova, O, Lebart, M.C, Egelman, E.H.
Deposit date:2008-01-16
Release date:2008-02-19
Last modified:2024-02-21
Method:ELECTRON MICROSCOPY (12 Å)
Cite:High-resolution cryo-EM structure of the F-actin-fimbrin/plastin ABD2 complex.
Proc.Natl.Acad.Sci.Usa, 105, 2008

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