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3IOH
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BU of 3ioh by Molmil
Crystal structure of the Fucosylgalactoside alpha N-acetylgalactosaminyltransferase (GTA, cisAB mutant L266G, G268A)
Descriptor: GLYCEROL, Histo-blood group ABO system transferase
Authors:Pesnot, T, Jorgensen, R, Palcic, M.M, Wagner, G.K.
Deposit date:2009-08-14
Release date:2010-04-07
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Structural and mechanistic basis for a new mode of glycosyltransferase inhibition.
Nat.Chem.Biol., 6, 2010
2XGP
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BU of 2xgp by Molmil
Yeast DNA polymerase eta in complex with C8-2-acetylaminofluorene containing DNA
Descriptor: 5'-D(*CP*8FG*CP*TP*CP*AP*TP*CP*CP*AP*C)-3', 5'-D(*GP*TP*GP*GP*AP*TP*GP*AP*G)-3', CALCIUM ION, ...
Authors:Scheider, S, Lammens, K, Schorr, S, Hopfner, K.P, Carell, T.
Deposit date:2010-06-07
Release date:2010-11-03
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Mechanism of Replication Blocking and Bypass of Y-Family Polymerase Eta by Bulky Acetylaminofluorene DNA Adducts.
Proc.Natl.Acad.Sci.USA, 107, 2010
2IVB
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BU of 2ivb by Molmil
SITE DIRECTED MUTAGENESIS OF KEY RESIDUES INVOLVED IN THE CATALYTIC MECHANISM OF CYANASE
Descriptor: AZIDE ION, CHLORIDE ION, CYANATE HYDRATASE, ...
Authors:Guilloton, M, Walsh, M.A, Joachimiak, A, Anderson, P.M.
Deposit date:2006-06-09
Release date:2008-10-28
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:A Twin Set of Low Pka Arginines Ensures the Concerted Acid Base Catalytic Mechanism of Cyanase
To be Published
5M61
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BU of 5m61 by Molmil
Clathrin heavy chain N-terminal domain bound to an extended amphiphysin clathrin-box motif
Descriptor: Amphiphysin, Clathrin heavy chain 1, GLYCEROL
Authors:Muenzner, J, Graham, S.C.
Deposit date:2016-10-23
Release date:2016-11-23
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.84 Å)
Cite:Cellular and viral peptides bind multiple sites on the N-terminal domain of clathrin.
Traffic, 18, 2017
2XGC
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BU of 2xgc by Molmil
Crystal structure of a designed heterodimeric variant T-A(I)B of the tetracycline repressor
Descriptor: TETRACYCLINE REPRESSOR PROTEIN CLASS B FROM TRANSPOSON TN10, TETRACYCLINE REPRESSOR PROTEIN CLASS D
Authors:Stiebritz, M.T, Wengrzik, S, Richter, J.P, Muller, Y.A.
Deposit date:2010-06-03
Release date:2010-09-22
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Computational Design of a Chain-Specific Tetracycline Repressor Heterodimer.
J.Mol.Biol., 403, 2010
7U1Z
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BU of 7u1z by Molmil
Crystal structure of the DRBD and CROPs of TcdA
Descriptor: SULFATE ION, Toxin A
Authors:Baohua, C, Peng, C, Kay, P, Rongsheng, J.
Deposit date:2022-02-22
Release date:2022-03-09
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (3.18 Å)
Cite:Structure and conformational dynamics of Clostridioides difficile toxin A.
Life Sci Alliance, 5, 2022
3IW0
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BU of 3iw0 by Molmil
Crystal structure of Mycobacterium tuberculosis cytochrome P450 CYP125, C2221 crystal form
Descriptor: Cytochrome P450 CYP125, PHOSPHATE ION, PROTOPORPHYRIN IX CONTAINING FE
Authors:McLean, K.J, Levy, C, Munro, A.W, Leys, D.
Deposit date:2009-09-02
Release date:2009-11-03
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:The Structure of Mycobacterium tuberculosis CYP125: molecular basis for cholesterol binding in a P450 needed for host infection.
J.Biol.Chem., 284, 2009
2IVQ
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BU of 2ivq by Molmil
SITE DIRECTED MUTAGENESIS OF KEY RESIDUES INVOLVED IN THE CATALYTIC MECHANISM OF CYANASE
Descriptor: CHLORIDE ION, CYANATE HYDRATASE, SULFATE ION
Authors:Guilloton, M, Walsh, M.A, Joachimiak, A, Anderson, P.M.
Deposit date:2006-06-14
Release date:2008-10-28
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:A Twin Set of Low Pka Arginines Ensures the Concerted Acid Base Catalytic Mechanism of Cyanase
To be Published
5MAT
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BU of 5mat by Molmil
Structure of human Sirtuin 2 in complex with a selective thienopyrimidinone based inhibitor
Descriptor: (7~{R})-7-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-3-[(4-methoxynaphthalen-1-yl)methyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, HEXAETHYLENE GLYCOL, NAD-dependent protein deacetylase sirtuin-2, ...
Authors:Moniot, S, Steegborn, C.
Deposit date:2016-11-04
Release date:2017-02-08
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.069 Å)
Cite:Thienopyrimidinone Based Sirtuin-2 (SIRT2)-Selective Inhibitors Bind in the Ligand Induced Selectivity Pocket.
J. Med. Chem., 60, 2017
3INK
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BU of 3ink by Molmil
UNRAVELING THE STRUCTURE OF INTERLEUKIN-2: REPLY
Descriptor: INTERLEUKIN-2
Authors:Mckay, D.B, Brandhuber, B.J.
Deposit date:1992-12-09
Release date:1993-10-31
Last modified:2024-06-05
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Response.
Science, 257, 1992
7BST
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BU of 7bst by Molmil
EcoR124I-Ocr in the Intermediate State
Descriptor: Overcome classical restriction gp0.3, Type I restriction enzyme EcoR124II M protein, Type I restriction enzyme R Protein, ...
Authors:Gao, Y, Gao, P.
Deposit date:2020-03-31
Release date:2020-05-27
Last modified:2024-03-27
Method:ELECTRON MICROSCOPY (4.37 Å)
Cite:Structural insights into assembly, operation and inhibition of a type I restriction-modification system.
Nat Microbiol, 5, 2020
3ICB
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BU of 3icb by Molmil
THE REFINED STRUCTURE OF VITAMIN D-DEPENDENT CALCIUM-BINDING PROTEIN FROM BOVINE INTESTINE. MOLECULAR DETAILS, ION BINDING, AND IMPLICATIONS FOR THE STRUCTURE OF OTHER CALCIUM-BINDING PROTEINS
Descriptor: CALCIUM ION, CALCIUM-BINDING PROTEIN, SULFATE ION
Authors:Szebenyi, D.M.E, Moffat, K.
Deposit date:1986-09-09
Release date:1986-10-24
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:The refined structure of vitamin D-dependent calcium-binding protein from bovine intestine. Molecular details, ion binding, and implications for the structure of other calcium-binding proteins.
J.Biol.Chem., 261, 1986
2XDP
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BU of 2xdp by Molmil
Crystal structure of the tudor domain of human JMJD2C
Descriptor: LYSINE-SPECIFIC DEMETHYLASE 4C, SULFATE ION
Authors:Yue, W.W, Gileadi, C, Krojer, T, Weisbach, H, Ugochukwu, E, Daniel, M, Phillips, C, Chaikuad, A, von Delft, F, Allerston, C, Arrowsmith, C, Weigelt, J, Edwards, A, Bountra, C, Oppermann, U.
Deposit date:2010-05-06
Release date:2010-06-09
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.56 Å)
Cite:Crystal Structure of the Tudor Domain of Human Jmjd2C
To be Published
8PQX
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BU of 8pqx by Molmil
p97 (VCP) mutant - F539A state III
Descriptor: ADENOSINE-5'-DIPHOSPHATE, ADENOSINE-5'-TRIPHOSPHATE, Transitional endoplasmic reticulum ATPase
Authors:Arie, M, Matzov, D, Karmona, R, Szenkier, N, Stanhill, A, Navon, A.
Deposit date:2023-07-12
Release date:2024-05-29
Method:ELECTRON MICROSCOPY (3.3 Å)
Cite:p97 (VCP) mutant - F539A state III
To Be Published
7JR4
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BU of 7jr4 by Molmil
SARS-CoV-2 3CL protease with alternative conformation of the active site promoted by methylene-bridged cysteine and lysine residues
Descriptor: 3C-like proteinase, DIMETHYL SULFOXIDE
Authors:Nascimento, A.F.Z, de Oliveira, R.R, Zeri, A.C.M, Trivella, D.B.B.
Deposit date:2020-08-11
Release date:2020-08-26
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:SARS-CoV-2 3CL protease with alternative conformation of the active site promoted by methylene-bridged cysteine and lysine residues
To be Published
7TQV
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BU of 7tqv by Molmil
SARS-CoV-2 endoribonuclease Nsp15 bound to dsRNA
Descriptor: RNA (33-MER), Uridylate-specific endoribonuclease
Authors:Frazier, M.N, Krahn, J.M, Butay, K.J, Dillard, L.B, Borgnia, M.J, Stanley, R.E.
Deposit date:2022-01-27
Release date:2022-03-23
Last modified:2024-06-12
Method:ELECTRON MICROSCOPY (3.43 Å)
Cite:Flipped over U: structural basis for dsRNA cleavage by the SARS-CoV-2 endoribonuclease.
Nucleic Acids Res., 50, 2022
7JSH
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BU of 7jsh by Molmil
Adeno-Associated Virus 2 Rep68 HD Heptamer-ssAAVS1 with ATPgS
Descriptor: DNA (5'-D(P*CP*GP*CP*TP*CP*GP*CP*TP*CP*GP*CP*TP*CP*GP*C)-3'), Protein Rep68
Authors:Escalante, C.R.
Deposit date:2020-08-14
Release date:2020-12-09
Last modified:2024-03-06
Method:ELECTRON MICROSCOPY (4.4 Å)
Cite:The Cryo-EM structure of AAV2 Rep68 in complex with ssDNA reveals a malleable AAA+ machine that can switch between oligomeric states.
Nucleic Acids Res., 48, 2020
3J40
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BU of 3j40 by Molmil
Validated Near-Atomic Resolution Structure of Bacteriophage Epsilon15 Derived from Cryo-EM and Modeling
Descriptor: gp10, gp7
Authors:Baker, M.L, Hryc, C.F, Zhang, Q, Wu, W, Jakana, J, Haase-Pettingell, C, Afonine, P.V, Adams, P.D, King, J.A, Jiang, W, Chiu, W.
Deposit date:2013-05-30
Release date:2013-07-10
Last modified:2024-02-21
Method:ELECTRON MICROSCOPY (4.5 Å)
Cite:Validated near-atomic resolution structure of bacteriophage epsilon15 derived from cryo-EM and modeling.
Proc.Natl.Acad.Sci.USA, 110, 2013
7BOM
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BU of 7bom by Molmil
Crystal structure of recombinant horse spleen apo-R52C/E56C/R59C/E63C-Fr immobilized with gold ions.
Descriptor: 1,2-ETHANEDIOL, CADMIUM ION, CHLORIDE ION, ...
Authors:Hishikawa, Y, Maity, B, Ito, N, Abe, S, Lu, D, Ueno, T.
Deposit date:2020-03-19
Release date:2021-01-27
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.93 Å)
Cite:Design of Multinuclear Gold Binding Site at the Two-fold Symmetric Interface of the Ferritin Cage
Chem Lett., 49, 2021
3J1X
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BU of 3j1x by Molmil
A refined model of the prototypical Salmonella typhimurium T3SS basal body reveals the molecular basis for its assembly
Descriptor: Protein PrgH
Authors:Sgourakis, N.G, Bergeron, J.R.C, Worrall, L.J, Strynadka, N.C.J, Baker, D.
Deposit date:2012-07-10
Release date:2013-05-22
Last modified:2024-02-21
Method:ELECTRON MICROSCOPY (11.7 Å)
Cite:A Refined Model of the Prototypical Salmonella SPI-1 T3SS Basal Body Reveals the Molecular Basis for Its Assembly.
Plos Pathog., 9, 2013
2XNN
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BU of 2xnn by Molmil
Structure of Nek2 bound to CCT242430
Descriptor: 1,2-ETHANEDIOL, 5-(1H-benzimidazol-1-yl)-3-{(1R)-1-[2-(trifluoromethyl)phenyl]ethoxy}thiophene-2-carboxamide, CHLORIDE ION, ...
Authors:Mas-Droux, C, Bayliss, R.
Deposit date:2010-08-05
Release date:2011-03-30
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Benzimidazole Inhibitors Induce a Dfg-Out Conformation of Never in Mitosis Gene A-Related Kinase 2 (Nek2) without Binding to the Back Pocket and Reveal a Nonlinear Structure-Activity Relationship.
J.Med.Chem., 54, 2011
2MR3
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BU of 2mr3 by Molmil
A subunit of 26S proteasome lid complex
Descriptor: 26S proteasome regulatory subunit RPN9
Authors:Wu, Y, Hu, Y, Jin, C.
Deposit date:2014-06-30
Release date:2015-02-04
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Solution structure of yeast Rpn9: insights into proteasome lid assembly.
J. Biol. Chem., 290, 2015
2MUZ
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BU of 2muz by Molmil
ssNMR structure of a designed rocker protein
Descriptor: designed rocker protein
Authors:Wang, T, Joh, N, Wu, Y, DeGrado, W.F, Hong, M.
Deposit date:2014-09-18
Release date:2014-12-24
Last modified:2015-01-14
Method:SOLUTION NMR
Cite:De novo design of a transmembrane Zn2+-transporting four-helix bundle.
Science, 346, 2014
7BOV
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BU of 7bov by Molmil
The Structure of Bacillus subtilis glycosyltransferase,Bs-YjiC
Descriptor: GLYCEROL, SODIUM ION, Uncharacterized UDP-glucosyltransferase YjiC
Authors:Zhao, C, Liu, B, Zhao, N.L, Luo, Y.Z, Bao, R.
Deposit date:2020-03-20
Release date:2020-05-13
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.293 Å)
Cite:Structural and biochemical studies of the glycosyltransferase Bs-YjiC from Bacillus subtilis.
Int.J.Biol.Macromol., 166, 2021
7JN4
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BU of 7jn4 by Molmil
Rubisco in the apo state
Descriptor: Ribulose bisphosphate carboxylase large chain, Ribulose bisphosphate carboxylase small chain 2, chloroplastic
Authors:Matthies, D, Jonikas, M.C, He, S.
Deposit date:2020-08-03
Release date:2020-11-18
Last modified:2020-12-23
Method:ELECTRON MICROSCOPY (2.68 Å)
Cite:The structural basis of Rubisco phase separation in the pyrenoid.
Nat.Plants, 6, 2020

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