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7TU3
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BU of 7tu3 by Molmil
Structure of the L. blandensis dGTPase del55-58 mutant
Descriptor: 1,2-ETHANEDIOL, MAGNESIUM ION, SULFATE ION, ...
Authors:Sikkema, A.P, Klemm, B.P, Horng, J.C, Hall, T.M.T.
Deposit date:2022-02-02
Release date:2022-06-01
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.17 Å)
Cite:High-resolution structures of the SAMHD1 dGTPase homolog from Leeuwenhoekiella blandensis reveal a novel mechanism of allosteric activation by dATP.
J.Biol.Chem., 298, 2022
7TU4
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BU of 7tu4 by Molmil
Structure of the L. blandensis dGTPase del55-58 mutant bound to Mn
Descriptor: 1,2-ETHANEDIOL, MANGANESE (II) ION, SULFATE ION, ...
Authors:Sikkema, A.P, Klemm, B.P, Horng, J.C, Hall, T.M.T.
Deposit date:2022-02-02
Release date:2022-06-01
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.26 Å)
Cite:High-resolution structures of the SAMHD1 dGTPase homolog from Leeuwenhoekiella blandensis reveal a novel mechanism of allosteric activation by dATP.
J.Biol.Chem., 298, 2022
6HVK
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BU of 6hvk by Molmil
Pepducin UT-Pep2 a biased allosteric agonist of Urotensin-II receptor
Descriptor: Urotensin-2 receptor
Authors:Carotenuto, A, Hoang, T.A, Nassour, H, Martin, R.D, Billard, E, Myriam, L, Novellino, E, Tanny, J.C, Fournier, A, Hebert, T.E, Chatenet, D.
Deposit date:2018-10-11
Release date:2019-10-30
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Lipidated peptides derived from intracellular loops 2 and 3 of the urotensin II receptor act as biased allosteric ligands.
J.Biol.Chem., 297, 2021
8SAH
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BU of 8sah by Molmil
Huntingtin C-HEAT domain in complex with HAP40
Descriptor: 40-kDa huntingtin-associated protein, Huntingtin
Authors:Harding, R.J, Deme, J.C, Alteen, M.G, Arrowsmith, C.H, Lea, S.M, Structural Genomics Consortium (SGC)
Deposit date:2023-03-31
Release date:2023-04-26
Last modified:2023-09-20
Method:ELECTRON MICROSCOPY (3.2 Å)
Cite:Delineation of functional subdomains of Huntingtin protein and their interaction with HAP40.
Structure, 31, 2023
8RAT
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BU of 8rat by Molmil
EFFECTS OF TEMPERATURE ON PROTEIN STRUCTURE AND DYNAMICS: X-RAY CRYSTALLOGRAPHIC STUDIES OF THE PROTEIN RIBONUCLEASE-A AT NINE DIFFERENT TEMPERATURES FROM 98 TO 320 K
Descriptor: RIBONUCLEASE A
Authors:Tiltonjunior, R.F, Dewan, J.C, Petsko, G.A.
Deposit date:1991-08-13
Release date:1993-07-15
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Effects of temperature on protein structure and dynamics: X-ray crystallographic studies of the protein ribonuclease-A at nine different temperatures from 98 to 320 K.
Biochemistry, 31, 1992
6NHK
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BU of 6nhk by Molmil
Mortalin nucleotide binding domain in the ADP-bound state
Descriptor: ADENOSINE-5'-DIPHOSPHATE, GLYCEROL, MAGNESIUM ION, ...
Authors:Page, R.C, Moseng, M.A, Nix, J.C.
Deposit date:2018-12-23
Release date:2019-04-17
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.777 Å)
Cite:Biophysical Consequences of EVEN-PLUS Syndrome Mutations for the Function of Mortalin.
J.Phys.Chem.B, 123, 2019
1L2C
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BU of 1l2c by Molmil
MutM (Fpg)-DNA Estranged Thymine Mismatch Recognition Complex
Descriptor: 5'-D(*AP*G*GP*TP*AP*GP*AP*CP*TP*TP*GP*GP*AP*CP*GP*C)-3', 5'-D(*TP*GP*C*GP*TP*CP*CP*AP*(HPD)P*GP*TP*CP*TP*AP*CP*C)-3', MutM, ...
Authors:Fromme, J.C, Verdine, G.L.
Deposit date:2002-02-20
Release date:2002-06-14
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural insights into lesion recognition and repair by the bacterial 8-oxoguanine DNA glycosylase MutM.
Nat.Struct.Biol., 9, 2002
6O1Z
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BU of 6o1z by Molmil
Structure of pCW3 conjugation coupling protein TcpA hexagonal crystal form
Descriptor: DNA translocase coupling protein
Authors:Traore, D.A.K, Ahktar, N, Torres, V.T, Adams, V, Coulibaly, F, Panjikar, S, Caradoc-Davies, T.T, Rood, J.I, Whisstock, J.C.
Deposit date:2019-02-22
Release date:2020-03-04
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Structure of pCW3 conjugation coupling protein TcpA
To be published
1L1T
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BU of 1l1t by Molmil
MutM (Fpg) Bound to Abasic-Site Containing DNA
Descriptor: 5'-D(*AP*G*GP*TP*AP*GP*AP*CP*CP*TP*GP*GP*AP*CP*GP*C)-3', 5'-D(*TP*GP*C*GP*TP*CP*CP*AP*(HPD)P*GP*TP*CP*TP*AP*CP*C)-3', MutM, ...
Authors:Fromme, J.C, Verdine, G.L.
Deposit date:2002-02-19
Release date:2002-06-14
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural insights into lesion recognition and repair by the bacterial 8-oxoguanine DNA glycosylase MutM.
Nat.Struct.Biol., 9, 2002
1L2G
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BU of 1l2g by Molmil
Structure of a C-terminally truncated form of glycoprotein D from HSV-1
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Glycoprotein D
Authors:Carfi, A, Willis, S.H, Whitbeck, J.C, Krummenacher, C, Cohen, G.H, Eisenberg, R.J, Wiley, D.C.
Deposit date:2002-02-21
Release date:2003-12-16
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:Herpes simplex virus glycoprotein D bound to the human receptor HveA.
Mol.Cell, 8, 2001
1LN0
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BU of 1ln0 by Molmil
Structure of the Catalytic Domain of Homing Endonuclease I-TevI
Descriptor: SULFATE ION, intron-associated endonuclease 1
Authors:Van Roey, P, Meehan, L, Kowalski, J.C, Belfort, M, Derbyshire, V.
Deposit date:2002-05-02
Release date:2002-10-30
Last modified:2021-10-27
Method:X-RAY DIFFRACTION (2 Å)
Cite:Catalytic domain structure and hypothesis for function of GIY-YIG intron endonuclease I-TevI.
Nat.Struct.Biol., 9, 2002
6O1Y
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BU of 6o1y by Molmil
Structure of pCW3 conjugation coupling protein TcpA monomeric form with ATP
Descriptor: ADENOSINE-5'-TRIPHOSPHATE, DNA translocase coupling protein, beta-D-glucopyranose
Authors:Traore, D.A.K, Ahktar, N, Torres, V.T, Adams, V, Coulibaly, F, Panjikar, S, Caradoc-Davies, T.T, Rood, J.I, Whisstock, J.C.
Deposit date:2019-02-22
Release date:2020-02-26
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Structure of pCW3 conjugation coupling protein TcpA
To be published
6NOZ
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BU of 6noz by Molmil
X-ray structure of PEDV papain-like protease 2
Descriptor: GLYCEROL, Polyprotein, ZINC ION
Authors:Clasman, J.C, Mesecar, A.D, Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2019-01-16
Release date:2020-01-22
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Evaluating ubiquitin specificity of papain-like protease 2 from alphacoronaviruses FIPV and PEDV using structure-guided engineering
To Be Published
1L8W
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BU of 1l8w by Molmil
Crystal Structure of Lyme Disease Variable Surface Antigen VlsE of Borrelia burgdorferi
Descriptor: VlsE1
Authors:Eicken, C, Sharma, V, Klabunde, T, Lawrenz, M.B, Hardham, J.M, Norris, S.J, Sacchettini, J.C.
Deposit date:2002-03-21
Release date:2002-06-19
Last modified:2018-03-07
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structure of Lyme disease variable surface antigen VlsE of Borrelia burgdorferi.
J.Biol.Chem., 277, 2002
1LJU
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BU of 1lju by Molmil
X-RAY STRUCTURE OF C15A ARSENATE REDUCTASE FROM PI258 COMPLEXED WITH ARSENITE
Descriptor: POTASSIUM ION, arsenate reductase
Authors:Zegers, I, Martins, J.C, Willem, R, Wyns, L, Messens, J.
Deposit date:2002-04-22
Release date:2002-08-07
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:All intermediates of the arsenate reductase mechanism, including an intramolecular dynamic disulfide cascade.
Proc.Natl.Acad.Sci.USA, 99, 2002
6O1W
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BU of 6o1w by Molmil
Structure of pCW3 conjugation coupling protein TcpA monomer orthorhombic crystal form
Descriptor: DNA translocase coupling protein, beta-D-glucopyranose
Authors:Traore, D.A.K, Ahktar, N, Torres, V.T, Adams, V, Coulibaly, F, Panjikar, S, Caradoc-Davies, T.T, Rood, J.I, Whisstock, J.C.
Deposit date:2019-02-22
Release date:2020-02-26
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structure of pCW3 conjugation coupling protein TcpA
To be published
1LT8
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BU of 1lt8 by Molmil
Reduced Homo sapiens Betaine-Homocysteine S-Methyltransferase in Complex with S-(delta-carboxybutyl)-L-Homocysteine
Descriptor: BETAINE-HOMOCYSTEINE METHYLTRANSFERASE, CITRIC ACID, S-(D-CARBOXYBUTYL)-L-HOMOCYSTEINE, ...
Authors:Evans, J.C, Huddler, D.P, Jiracek, J, Castro, C, Millian, N.S, Garrow, T.A, Ludwig, M.L.
Deposit date:2002-05-20
Release date:2002-09-11
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Betaine-homocysteine methyltransferase: zinc in a distorted barrel.
Structure, 10, 2002
1LPH
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BU of 1lph by Molmil
LYS(B28)PRO(B29)-HUMAN INSULIN
Descriptor: CHLORIDE ION, INSULIN, PHENOL, ...
Authors:Ciszak, E, Beals, J.M, Frank, B.H, Baker, J.C, Carter, N.D, Smith, G.D.
Deposit date:1995-04-19
Release date:1996-06-20
Last modified:2021-11-03
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Role of C-terminal B-chain residues in insulin assembly: the structure of hexameric LysB28ProB29-human insulin.
Structure, 3, 1995
1LWW
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BU of 1lww by Molmil
Borohydride-trapped hOgg1 Intermediate Structure Co-Crystallized with 8-bromoguanine
Descriptor: 5'-D(*GP*CP*GP*TP*CP*CP*AP*(PED)P*GP*TP*CP*TP*AP*CP*C)-3', 5'-D(*GP*GP*TP*AP*GP*AP*CP*CP*TP*GP*GP*AP*CP*GP*C)-3', 8-BROMOGUANINE, ...
Authors:Fromme, J.C, Bruner, S.D, Yang, W, Karplus, M, Verdine, G.L.
Deposit date:2002-06-03
Release date:2003-02-25
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Product-Assisted Catalysis in Base Excision DNA Repair
Nat.Struct.Biol., 10, 2003
8FY3
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BU of 8fy3 by Molmil
Structure of NOT1:NOT10:NOT11 module of the human CCR4-NOT complex
Descriptor: CCR4-NOT transcription complex subunit 1, CCR4-NOT transcription complex subunit 10, CCR4-NOT transcription complex subunit 11
Authors:Lea, S.M, Deme, J.C, Raisch, T, Pekovic, F, Valkov, E.
Deposit date:2023-01-25
Release date:2023-07-26
Last modified:2023-08-02
Method:ELECTRON MICROSCOPY (2.88 Å)
Cite:Structure and assembly of the NOT10:11 module of the CCR4-NOT complex.
Commun Biol, 6, 2023
8FY4
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BU of 8fy4 by Molmil
Structure of NOT1:NOT10:NOT11 module of the chicken CCR4-NOT complex
Descriptor: CCR4-NOT transcription complex subunit 1, CCR4-NOT transcription complex subunit 10, CCR4-NOT transcription complex subunit 11
Authors:Lea, S.M, Deme, J.C, Raisch, T, Levdansky, Y, Valkov, E.
Deposit date:2023-01-25
Release date:2023-08-30
Method:ELECTRON MICROSCOPY (2.57 Å)
Cite:Structure and assembly of the NOT10:11 module of the CCR4-NOT complex.
Commun Biol, 6, 2023
8FWO
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BU of 8fwo by Molmil
Crystal structure of SARS-CoV-2 papain-like protease
Descriptor: CHLORIDE ION, GLYCEROL, PHOSPHATE ION, ...
Authors:Bezerra, E.H.S, Soprano, A.S, Tonoli, C.C.C, Prado, P.F.V, da Silva, J.C, Franchini, K.G, Trivella, D.B.B, Benedetti, C.E.
Deposit date:2023-01-23
Release date:2024-01-31
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure of SARS-CoV-2 papain-like protease
To Be Published
8G8N
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BU of 8g8n by Molmil
CTLA4 Fab with peptide
Descriptor: CYS-PRO-GLY-LYS-GLY-LEU-PRO-SER-CYS, Fab heavy chain, Fab light chain
Authors:Williams, J.C.
Deposit date:2023-02-18
Release date:2024-01-17
Method:X-RAY DIFFRACTION (3 Å)
Cite:XTX101, a tumor-activated, Fc-enhanced anti-CTLA-4 monoclonal antibody, demonstrates tumor-growth inhibition and tumor-selective pharmacodynamics in mouse models of cancer.
J Immunother Cancer, 11, 2023
8GIA
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BU of 8gia by Molmil
Crystal structure of SARS-CoV-2 (Covid-19) Nsp3 macrodomain in complex with TFMU-ADPr
Descriptor: Non-structural protein 3, [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [(2R,3S,4R,5R)-3,4-dihydroxy-5-{[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]oxy}oxolan-2-yl]methyl dihydrogen diphosphate
Authors:Wallace, S.D, Bagde, S.R, Fromme, J.C.
Deposit date:2023-03-13
Release date:2023-05-17
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.86 Å)
Cite:A Fluorescence Polarization Assay for Macrodomains Facilitates the Identification of Potent Inhibitors of the SARS-CoV-2 Macrodomain.
Acs Chem.Biol., 18, 2023
8GMH
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BU of 8gmh by Molmil
Crystal Structure of the ternary complex of TelA-LXG, LapA3, and LapA4
Descriptor: 1,2-ETHANEDIOL, LXG domain-containing protein, LapA3, ...
Authors:Klein, T.A, Shah, P.Y, Gkragkopoulou, P, Grebenc, D.W, Kim, Y, Whitney, J.C.
Deposit date:2023-03-25
Release date:2024-01-10
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structure of a tripartite protein complex that targets toxins to the type VII secretion system.
Proc.Natl.Acad.Sci.USA, 121, 2024

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