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4A0F
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BU of 4a0f by Molmil
Structure of selenomethionine substituted bifunctional DAPA aminotransferase-dethiobiotin synthetase from Arabidopsis thaliana in its apo form.
Descriptor: ADENOSYLMETHIONINE-8-AMINO-7-OXONONANOATE AMINOTRANSFERASE, PYRIDOXAL-5'-PHOSPHATE, SULFATE ION
Authors:Cobessi, D, Dumas, R, Pautre, V, Meinguet, C, Ferrer, J.L, Alban, C.
Deposit date:2011-09-09
Release date:2012-06-13
Method:X-RAY DIFFRACTION (2.714 Å)
Cite:Biochemical and Structural Characterization of the Arabidopsis Bifunctional Enzyme Dethiobiotin Synthetase-Diaminopelargonic Acid Aminotransferase: Evidence for Substrate Channeling in Biotin Synthesis.
Plant Cell, 24, 2012
4AB1
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Recombinant Human Carboxylesterase 1 from whole Cabbage Loopers
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, LIVER CARBOXYLESTERASE 1, THIOCYANATE ION
Authors:Greenblatt, H.M, Otto, T.C, Cerasoli, D.M, Sussman, J.L.
Deposit date:2011-12-06
Release date:2012-03-07
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structure of Recombinant Human Carboxylesterase 1 Isolated from Whole Cabbage Looper Larvae.
Acta Crystallogr.,Sect.F, 68, 2012
4AQC
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BU of 4aqc by Molmil
Triazolopyridine-based Inhibitor of Janus Kinase 2
Descriptor: 8-(4-methylsulfonylphenyl)-N-(4-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine, SULFATE ION, TYROSINE-PROTEIN KINASE JAK2
Authors:Dugan, B.J, Gingrich, D.E, Mesaros, E.F, Milkiewicz, K.L, Curry, M.A, Zulli, A.L, Dobrzanski, P, Serdikoff, C, Jan, M, Angeles, T.S, Albom, M.S, Mason, J.L, Aimone, L.D, Meyer, S.L, Huang, Z, Wells-Knecht, K.J, Ator, M.A, Ruggeri, B.A, Dorsey, B.D.
Deposit date:2012-04-16
Release date:2012-04-25
Last modified:2019-05-08
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:A Selective, Orally Bioavailable 1,2,4-Triazolo[1,5-A]Pyridine-Based Inhibitor of Janus Kinase 2 for Use in Anticancer Therapy: Discovery of Cep-33779.
J.Med.Chem., 55, 2012
4ALX
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BU of 4alx by Molmil
Crystal Structure of Ls-AChBP complexed with the potent nAChR antagonist DHbE
Descriptor: (4bS,6S)-6-methoxy-1,4,6,7,9,10,12,13-octahydro-3H,5H-pyrano[4',3':3,4]pyrido[2,1-i]indol-3-one, ACETYLCHOLINE BINDING PROTEIN, MAGNESIUM ION, ...
Authors:Shahsavar, A, Kastrup, J.S, Nielsen, E.O, Kristensen, J.L, Gajhede, M, Balle, T.
Deposit date:2012-03-06
Release date:2012-08-29
Last modified:2018-01-17
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal Structure of Lymnaea Stagnalis Achbp Complexed with the Potent Nachr Antagonist Dh-Betab-E Suggests a Unique Mode of Antagonism
Plos One, 7, 2012
4AR0
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BU of 4ar0 by Molmil
N0 domain of Neisseria meningitidis Pilus assembly protein PilQ
Descriptor: TYPE IV PILUS BIOGENESIS AND COMPETENCE PROTEIN PILQ
Authors:Phelan, M.M, Berry, J.L, Derrick, J.P, Lian, L.Y.
Deposit date:2012-04-20
Release date:2012-10-17
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Structure and Assembly of a Trans-Periplasmic Channel for Type Iv Pili in Neisseria Meningitidis.
Plos Pathog., 8, 2012
4A0R
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BU of 4a0r by Molmil
Structure of bifunctional DAPA aminotransferase-DTB synthetase from Arabidopsis thaliana bound to dethiobiotin (DTB).
Descriptor: 6-(5-METHYL-2-OXO-IMIDAZOLIDIN-4-YL)-HEXANOIC ACID, ADENOSYLMETHIONINE-8-AMINO-7-OXONONANOATE AMINOTRANSFERASE, L(+)-TARTARIC ACID, ...
Authors:Cobessi, D, Dumas, R, Pautre, V, Meinguet, C, Ferrer, J.L, Alban, C.
Deposit date:2011-09-12
Release date:2012-06-13
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (2.68 Å)
Cite:Biochemical and Structural Characterization of the Arabidopsis Bifunctional Enzyme Dethiobiotin Synthetase-Diaminopelargonic Acid Aminotransferase: Evidence for Substrate Channeling in Biotin Synthesis.
Plant Cell, 24, 2012
3ZGN
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BU of 3zgn by Molmil
Crystal structures of Escherichia coli IspH in complex with TMBPP a potent inhibitor of the methylerythritol phosphate pathway
Descriptor: (2E)-3-methyl-4-sulfanylbut-2-en-1-yl trihydrogen diphosphate, 4-HYDROXY-3-METHYLBUT-2-ENYL DIPHOSPHATE REDUCTASE, IRON/SULFUR CLUSTER
Authors:Borel, F, Barbier, E, Kratsutsky, S, Janthawornpong, K, Rohmer, M, Dale Poulter, C, Ferrer, J.L, Seemann, M.
Deposit date:2012-12-18
Release date:2013-01-09
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Further Insight into Crystal Structures of Escherichia coli IspH/LytB in Complex with Two Potent Inhibitors of the MEP Pathway: A Starting Point for Rational Design of New Antimicrobials.
Chembiochem, 18, 2017
3ZUE
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BU of 3zue by Molmil
Rabbit Hemorrhagic Disease Virus (RHDV)capsid protein
Descriptor: CAPSID STRUCTURAL PROTEIN VP60
Authors:Luque, D, Gonzalez, J.M, Gomez-Blanco, J, Marabini, R, Chichon, J, Mena, I, Angulo, I, Carrascosa, J.L, Verdaguer, N, Trus, B.L, Barcena, J, Caston, J.R.
Deposit date:2011-07-18
Release date:2012-05-23
Last modified:2024-05-08
Method:ELECTRON MICROSCOPY (10.3 Å)
Cite:Epitope Insertion at the N-Terminal Molecular Switch of the Rabbit Hemorrhagic Disease Virus T=3 Capsid Protein Leads to Larger T=4 Capsids.
J.Virol., 86, 2012
3ZBY
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BU of 3zby by Molmil
Ligand-free structure of CYP142 from Mycobacterium smegmatis
Descriptor: 1,2-ETHANEDIOL, Cycloheptakis-(1-4)-(alpha-D-glucopyranose), P450 HEME-THIOLATE PROTEIN, ...
Authors:Garcia-Fernandez, E, Frank, D.J, Galan, B, Kells, P.M, Podust, L.M, Garcia, J.L, Ortiz de Montellano, P.R.
Deposit date:2012-11-13
Release date:2013-02-27
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.93 Å)
Cite:A Highly Conserved Mycobacterial Cholesterol Catabolic Pathway.
Environ.Microbiol., 15, 2013
4A0G
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BU of 4a0g by Molmil
Structure of bifunctional DAPA aminotransferase-DTB synthetase from Arabidopsis thaliana in its apo form.
Descriptor: ADENOSYLMETHIONINE-8-AMINO-7-OXONONANOATE AMINOTRANSFERASE, MAGNESIUM ION, PYRIDOXAL-5'-PHOSPHATE, ...
Authors:Cobessi, D, Dumas, R, Pautre, V, Meinguet, C, Ferrer, J.L, Alban, C.
Deposit date:2011-09-09
Release date:2012-06-13
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.502 Å)
Cite:Biochemical and Structural Characterization of the Arabidopsis Bifunctional Enzyme Dethiobiotin Synthetase-Diaminopelargonic Acid Aminotransferase: Evidence for Substrate Channeling in Biotin Synthesis.
Plant Cell, 24, 2012
4A0H
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BU of 4a0h by Molmil
Structure of bifunctional DAPA aminotransferase-DTB synthetase from Arabidopsis thaliana bound to 7-keto 8-amino pelargonic acid (KAPA)
Descriptor: 7-KETO-8-AMINOPELARGONIC ACID, ADENOSYLMETHIONINE-8-AMINO-7-OXONONANOATE AMINOTRANSFERASE, L(+)-TARTARIC ACID, ...
Authors:Cobessi, D, Dumas, R, Pautre, V, Meinguet, C, Ferrer, J.L, Alban, C.
Deposit date:2011-09-09
Release date:2012-06-13
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.808 Å)
Cite:Biochemical and Structural Characterization of the Arabidopsis Bifunctional Enzyme Dethiobiotin Synthetase-Diaminopelargonic Acid Aminotransferase: Evidence for Substrate Channeling in Biotin Synthesis.
Plant Cell, 24, 2012
4AB4
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BU of 4ab4 by Molmil
Structure of Xenobiotic Reductase B from Pseudomonas putida in complex with TNT
Descriptor: 1,2-ETHANEDIOL, 2,4,6-TRINITROTOLUENE, FLAVIN MONONUCLEOTIDE, ...
Authors:Carvalho, A.L, Mukhopadhyay, A, Romao, M.J, Bursakov, S, Kladova, A, Ramos, J.L, van Dillewijn, P.
Deposit date:2011-12-06
Release date:2012-12-19
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Structural Determinants of Aromatic Ring Reduction in the Xenobiotic Reductase B from Pseudomonas Putida
To be Published
3VAG
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BU of 3vag by Molmil
Structure of U2AF65 variant with BrU3C2 DNA
Descriptor: 1,4-DIETHYLENE DIOXIDE, DNA 5'-D(*U*CP*(BRU)P*UP*UP*UP*U)-3', GLYCEROL, ...
Authors:Jenkins, J.L, Kielkopf, C.L.
Deposit date:2011-12-29
Release date:2013-02-13
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.19 Å)
Cite:U2AF65 adapts to diverse pre-mRNA splice sites through conformational selection of specific and promiscuous RNA recognition motifs.
Nucleic Acids Res., 41, 2013
3V7M
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BU of 3v7m by Molmil
Crystal structure of monoclonal human anti-Rhesus D Fc IgG1 T125(YB2/0) in the presence of Zn2+
Descriptor: GLYCEROL, IMIDAZOLE, Ig gamma-1 chain C region, ...
Authors:Menez, R, Stura, E.A, Bourel, D, Siberil, S, Jorieux, S, De Romeuf, C, Ducancel, F, Fridman, W.H, Teillaud, J.L.
Deposit date:2011-12-21
Release date:2012-02-22
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.02 Å)
Cite:Effect of zinc on human IgG1 and its Fc gamma R interactions.
Immunol.Lett., 143, 2012
3VAH
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BU of 3vah by Molmil
Structure of U2AF65 variant with BrU3C4 DNA
Descriptor: 1,4-DIETHYLENE DIOXIDE, DNA 5'-D(P*UP*UP*(BRU)P*CP*UP*UP*U)-3', GLYCEROL, ...
Authors:Jenkins, J.L, Kielkopf, C.L.
Deposit date:2011-12-29
Release date:2013-02-13
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:U2AF65 adapts to diverse pre-mRNA splice sites through conformational selection of specific and promiscuous RNA recognition motifs.
Nucleic Acids Res., 41, 2013
4AF1
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BU of 4af1 by Molmil
Archeal Release Factor aRF1
Descriptor: PEPTIDE CHAIN RELEASE FACTOR SUBUNIT 1, ZINC ION
Authors:Karlsen, J.L, Kjeldgaard, M.
Deposit date:2012-01-16
Release date:2013-03-20
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2 Å)
Cite:Archeal Release Factor Arf1 Contains a Metal Binding Domain
To be Published
4AEO
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BU of 4aeo by Molmil
Structure of Xenobiotic Reductase B from Pseudomonas putida in complex with TNT
Descriptor: 2,4,6-TRINITROTOLUENE, FLAVIN MONONUCLEOTIDE, GLYCEROL, ...
Authors:Carvalho, A.L, Mukhopadhyay, A, Romao, M.J, Bursakov, S, Kladova, A, Ramos, J.L, van Dillewijn, P.
Deposit date:2012-01-11
Release date:2013-01-30
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural Determinants of Aromatic Ring Reduction in the Xenobiotic Reductase B from Pseudomonas Putida
To be Published
2F3Z
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BU of 2f3z by Molmil
Calmodulin/IQ-AA domain complex
Descriptor: CALCIUM ION, Calmodulin, Voltage-dependent L-type calcium channel alpha-1C subunit
Authors:Fallon, J.L, Quiocho, F.A.
Deposit date:2005-11-22
Release date:2005-12-27
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Structure of Calmodulin Bound to the Hydrophobic IQ Domain of the Cardiac Ca(v)1.2 Calcium Channel.
Structure, 13, 2005
2F3Y
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BU of 2f3y by Molmil
Calmodulin/IQ domain complex
Descriptor: CALCIUM ION, Calmodulin, MAGNESIUM ION, ...
Authors:Fallon, J.L, Quiocho, F.A.
Deposit date:2005-11-22
Release date:2005-12-27
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Structure of Calmodulin Bound to the Hydrophobic IQ Domain of the Cardiac Ca(v)1.2 Calcium Channel.
Structure, 13, 2005
7T1D
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BU of 7t1d by Molmil
Human SIRT2 in complex with small molecule 359
Descriptor: 1,2-ETHANEDIOL, 7-(2,4-dimethyl-1H-imidazol-1-yl)-2-(5-{[4-(1H-pyrazol-1-yl)phenyl]methyl}-1,3-thiazol-2-yl)-1,2,3,4-tetrahydroisoquinoline, DIMETHYL SULFOXIDE, ...
Authors:Kulp, J.L, Remiszewski, S, Todd, M, Chiang, L.W.
Deposit date:2021-12-01
Release date:2023-05-17
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:An allosteric inhibitor of sirtuin 2 deacetylase activity exhibits broad-spectrum antiviral activity.
J.Clin.Invest., 133, 2023
7TK7
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BU of 7tk7 by Molmil
Yeast ATP synthase State 1catalytic(b) with 10 mM ATP backbone model
Descriptor: ATP synthase protein 8, ATP synthase subunit 4, ATP synthase subunit 5, ...
Authors:Guo, H, Rubinstein, J.L.
Deposit date:2022-01-17
Release date:2022-04-20
Last modified:2024-02-21
Method:ELECTRON MICROSCOPY (6.7 Å)
Cite:Structure of ATP synthase under strain during catalysis.
Nat Commun, 13, 2022
7TK8
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BU of 7tk8 by Molmil
Yeast ATP synthase State 1catalytic(c) with 10 mM ATP backbone model
Descriptor: ATP synthase protein 8, ATP synthase subunit 4, ATP synthase subunit 5, ...
Authors:Guo, H, Rubinstein, J.L.
Deposit date:2022-01-17
Release date:2022-04-20
Last modified:2024-02-21
Method:ELECTRON MICROSCOPY (4.7 Å)
Cite:Structure of ATP synthase under strain during catalysis.
Nat Commun, 13, 2022
7TK0
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BU of 7tk0 by Molmil
Yeast ATP synthase State 1catalytic(c) without exogenous ATP backbone model
Descriptor: ATP synthase protein 8, ATP synthase subunit 4, ATP synthase subunit 5, ...
Authors:Guo, H, Rubinstein, J.L.
Deposit date:2022-01-17
Release date:2022-04-20
Last modified:2024-02-21
Method:ELECTRON MICROSCOPY (4.4 Å)
Cite:Structure of ATP synthase under strain during catalysis.
Nat Commun, 13, 2022
7TK6
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BU of 7tk6 by Molmil
Yeast ATP synthase State 1catalytic(a) with 10 mM ATP backbone model
Descriptor: ATP synthase protein 8, ATP synthase subunit 4, ATP synthase subunit 5, ...
Authors:Guo, H, Rubinstein, J.L.
Deposit date:2022-01-17
Release date:2022-04-20
Last modified:2024-02-21
Method:ELECTRON MICROSCOPY (6.5 Å)
Cite:Structure of ATP synthase under strain during catalysis.
Nat Commun, 13, 2022
7TKA
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BU of 7tka by Molmil
Yeast ATP synthase State 1catalytic(e) with 10 mM ATP backbone model
Descriptor: ATP synthase protein 8, ATP synthase subunit 4, ATP synthase subunit 5, ...
Authors:Guo, H, Rubinstein, J.L.
Deposit date:2022-01-17
Release date:2022-04-20
Last modified:2024-02-21
Method:ELECTRON MICROSCOPY (7.1 Å)
Cite:Structure of ATP synthase under strain during catalysis.
Nat Commun, 13, 2022

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