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7RMJ
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BU of 7rmj by Molmil
Disulfide stabilized HIV-1 CA hexamer in complex with capsid inhibitor (S)-N-(1-(3-(4-chloro-3-(methylsulfonamido)-1-(2,2,2-trifluoroethyl)-1H-indazol-7-yl)-6-(3-methyl-3-(methylsulfonyl)but-1-yn-1-yl)pyridin-2-yl)-2-(3,5-difluorophenyl)ethyl)-2-(3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl)acetamide
Descriptor: CAPSID PROTEIN P24, CHLORIDE ION, IODIDE ION, ...
Authors:Bester, S.M, Kvaratskhelia, M.
Deposit date:2021-07-27
Release date:2022-08-03
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.27 Å)
Cite:Structural and Mechanistic Bases of Viral Resistance to HIV-1 Capsid Inhibitor Lenacapavir.
Mbio, 13, 2022
7RMM
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BU of 7rmm by Molmil
Structure of N74D mutant of disulfide stabilized HIV-1 CA hexamer
Descriptor: CAPSID PROTEIN P24, CHLORIDE ION, IODIDE ION
Authors:Bester, S.M, Kvaratskhelia, M.
Deposit date:2021-07-27
Release date:2022-08-03
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Structural and Mechanistic Bases of Viral Resistance to HIV-1 Capsid Inhibitor Lenacapavir.
Mbio, 13, 2022
3ZCW
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BU of 3zcw by Molmil
Eg5 - New allosteric binding site
Descriptor: (2E)-2-(3-fluoranyl-4-methoxy-phenyl)imino-1-[[2-(trifluoromethyl)phenyl]methyl]-3H-benzimidazole-5-carboxylic acid, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ADENOSINE-5'-DIPHOSPHATE, ...
Authors:Ulaganathan, V, Talapatra, S.K, Kozielski, F, Pannifer, A.D.
Deposit date:2012-11-23
Release date:2013-01-23
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.691 Å)
Cite:Structural Insights Into a Unique Inhibitor Binding Pocket in Kinesin Spindle Protein.
J.Am.Chem.Soc., 135, 2013
5FLX
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BU of 5flx by Molmil
Mammalian 40S HCV-IRES complex
Descriptor: 18S RRNA, 40S RIBOSOMAL PROTEIN S10, 40S RIBOSOMAL PROTEIN S11, ...
Authors:Yamamoto, H, Collier, M, Loerke, J, Ismer, J, Schmidt, A, Hilal, T, Sprink, T, Yamamoto, K, Mielke, T, Burger, J, Shaikh, T.R, Dabrowski, M, Hildebrand, P.W, Scheerer, P, Spahn, C.M.T.
Deposit date:2015-10-28
Release date:2015-12-23
Last modified:2017-08-30
Method:ELECTRON MICROSCOPY (3.9 Å)
Cite:Molecular Architecture of the Ribosome-Bound Hepatitis C Virus Internal Ribosomal Entry Site RNA.
Embo J., 34, 2015
4CK6
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BU of 4ck6 by Molmil
Pseudo-atomic model of microtubule-bound human kinesin-5 motor domain in the ADP.AlFx state, based on cryo-electron microscopy experiment.
Descriptor: ADENOSINE-5'-DIPHOSPHATE, ALUMINUM FLUORIDE, GUANOSINE-5'-DIPHOSPHATE, ...
Authors:Goulet, A, Major, J, Jun, Y, Gross, S, Rosenfeld, S, Moores, C.
Deposit date:2013-12-30
Release date:2014-02-05
Last modified:2024-05-08
Method:ELECTRON MICROSCOPY (9.2 Å)
Cite:Comprehensive Structural Model of the Mechanochemical Cycle of a Mitotic Motor Highlights Molecular Adaptations in the Kinesin Family.
Proc.Natl.Acad.Sci.USA, 111, 2014
4CK7
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BU of 4ck7 by Molmil
Pseudo-atomic model of microtubule-bound human kinesin-5 motor domain in presence of adp.alfx (NECK-LINKER IN ITS DISCONNECTED CONFORMATION, based on cryo-electron microscopy experiment
Descriptor: ADENOSINE-5'-DIPHOSPHATE, ALUMINUM FLUORIDE, GUANOSINE-5'-DIPHOSPHATE, ...
Authors:Goulet, A, Major, J, Jun, Y, Gross, S, Rosenfeld, S, Moores, C.
Deposit date:2013-12-30
Release date:2014-02-05
Last modified:2024-05-08
Method:ELECTRON MICROSCOPY (9.2 Å)
Cite:Comprehensive Structural Model of the Mechanochemical Cycle of a Mitotic Motor Highlights Molecular Adaptations in the Kinesin Family.
Proc.Natl.Acad.Sci.USA, 111, 2014
5A6N
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BU of 5a6n by Molmil
Crystal structure of human death associated protein kinase 3 (DAPK3) in complex with compound 2
Descriptor: 5-(3-SULFAMOYLPHENYL)-1H-1,2,3,4-TETRAZOL-1-IDE, DEATH-ASSOCIATED PROTEIN KINASE 3, GLYCEROL, ...
Authors:Rodrigues, T, Reker, D, Welin, M, Caldera, M, Brunner, C, Gabernet, G, Schneider, P, Walse, B, Schneider, G.
Deposit date:2015-06-30
Release date:2015-10-21
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:De Novo Fragment Design for Drug Discovery and Chemical Biology.
Angew.Chem.Int.Ed.Engl., 54, 2015
4CK5
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BU of 4ck5 by Molmil
Pseudo-atomic model of microtubule-bound human kinesin-5 motor domain in the ADP state, based on cryo-electron microscopy experiment.
Descriptor: ADENOSINE-5'-DIPHOSPHATE, GUANOSINE-5'-DIPHOSPHATE, GUANOSINE-5'-TRIPHOSPHATE, ...
Authors:Goulet, A, Major, J, Jun, Y, Gross, S, Rosenfeld, S, Moores, C.
Deposit date:2013-12-30
Release date:2014-02-05
Last modified:2024-05-08
Method:ELECTRON MICROSCOPY (10 Å)
Cite:Comprehensive Structural Model of the Mechanochemical Cycle of a Mitotic Motor Highlights Molecular Adaptations in the Kinesin Family.
Proc.Natl.Acad.Sci.USA, 111, 2014
1UV4
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BU of 1uv4 by Molmil
Native Bacillus subtilis Arabinanase Arb43A
Descriptor: 1,2-ETHANEDIOL, ARABINAN-ENDO 1,5-ALPHA-L-ARABINASE, CALCIUM ION
Authors:Nurizzo, D, Taylor, E.J, Gilbert, H.J, Davies, G.J.
Deposit date:2004-01-14
Release date:2005-02-16
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Tailored Catalysts for Plant Cell-Wall Degradation: Redesigning the Exo/Endo Preference of Cellvibrio Japonicus Arabinanase 43A
Proc.Natl.Acad.Sci.USA, 102, 2005
4BJJ
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BU of 4bjj by Molmil
Sfc1-Sfc7 dimerization module
Descriptor: MERCURY (II) ION, TRANSCRIPTION FACTOR TAU SUBUNIT SFC1, TRANSCRIPTION FACTOR TAU SUBUNIT SFC7
Authors:Taylor, N.M.I, Baudin, F, von Scheven, G, Muller, C.W.
Deposit date:2013-04-18
Release date:2013-07-31
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:RNA Polymerase III-Specific General Transcription Factor Iiic Contains a Heterodimer Resembling Tfiif RAP30/RAP74.
Nucleic Acids Res., 41, 2013
4YGY
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BU of 4ygy by Molmil
Crystal Structure of Human Scp1 bound to trans-proline peptidomimetic CTD phospho-Ser5 peptide
Descriptor: Carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1, MAGNESIUM ION, peptidomimetic CTD phospho-Ser5 peptide
Authors:Mayfield, J.E, Zhang, Y.
Deposit date:2015-02-26
Release date:2015-09-16
Last modified:2015-10-28
Method:X-RAY DIFFRACTION (2.36 Å)
Cite:Chemical Tools To Decipher Regulation of Phosphatases by Proline Isomerization on Eukaryotic RNA Polymerase II.
Acs Chem.Biol., 10, 2015
4D2H
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BU of 4d2h by Molmil
Crystal structure of the tetramerisation domain of human CtIP
Descriptor: RBBP8, SULFATE ION
Authors:Davies, O.R, Sun, M, Pellegrini, L.
Deposit date:2014-05-09
Release date:2015-01-14
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Ctip Tetramer Assembly is Required for DNA-End Resection and Repair.
Nat.Struct.Mol.Biol., 22, 2015
5AGQ
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BU of 5agq by Molmil
Solution structure of the TAM domain of human TIP5 BAZ2A involved in epigenetic regulation of rRNA genes
Descriptor: BROMODOMAIN ADJACENT TO ZINC FINGER DOMAIN PROTEIN 2A
Authors:Anosova, I, Melnik, S, Tripsianes, K, Kateb, F, Grummt, I, Sattler, M.
Deposit date:2015-02-03
Release date:2015-05-06
Last modified:2024-06-19
Method:SOLUTION NMR
Cite:A Novel RNA Binding Surface of the Tam Domain of Tip5/Baz2A Mediates Epigenetic Regulation of Rrna Genes.
Nucleic Acids Res., 43, 2015
4BXN
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BU of 4bxn by Molmil
Eg5(WT) complex
Descriptor: ADENOSINE-5'-DIPHOSPHATE, CADMIUM ION, CHLORIDE ION, ...
Authors:Talapatra, S.K, Anthony, N.G, Mackay, S.P, Kozielski, F.
Deposit date:2013-07-15
Release date:2013-07-31
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.793 Å)
Cite:The Mitotic Kinesin Eg5 Overcomes Inhibition to the Phase I/II Clinical Candidate Sb743921 by an Allosteric Resistance Mechanism.
J.Med.Chem., 56, 2013
2Q5E
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BU of 2q5e by Molmil
Crystal structure of human carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 2
Descriptor: Carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 2, MAGNESIUM ION
Authors:Bonanno, J.B, Dickey, M, Bain, K.T, Lau, C, Romero, R, Smith, D, Wasserman, S, Sauder, J.M, Burley, S.K, Almo, S.C, New York SGX Research Center for Structural Genomics (NYSGXRC)
Deposit date:2007-05-31
Release date:2007-06-19
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.51 Å)
Cite:Structural genomics of protein phosphatases.
J.Struct.Funct.Genom., 8, 2007
2XAE
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BU of 2xae by Molmil
Crystal structure of human kinesin Eg5 in complex with (R)-2-amino-3-((S)-2-methyl-1,1-diphenylbutylthio)propanoic acid
Descriptor: (2R)-2-AMINO-3-[(4-CHLOROPHENYL)-DIPHENYL-METHYL]SULFANYL-PROPANOIC ACID, ADENOSINE-5'-DIPHOSPHATE, CHLORIDE ION, ...
Authors:Kaan, H.Y.K, Weiss, J, Menger, D, Ulaganathan, V, Tkocz, K, Laggner, C, Popowycz, F, Joseph, B, Kozielski, F.
Deposit date:2010-03-31
Release date:2011-03-30
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structure-Activity Relationship and Multidrug Resistance Study of New S-Trityl-L-Cysteine Derivatives as Inhibitors of Eg5.
J.Med.Chem., 54, 2011
2E5O
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BU of 2e5o by Molmil
'Solution structure of the TRIP_4C domain of target of activating signal cointegrator 1
Descriptor: Activating signal cointegrator 1
Authors:Dang, W, Muto, Y, Inoue, M, Kigawa, T, Shirouzu, M, Terada, T, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI)
Deposit date:2006-12-22
Release date:2008-01-01
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:Solution structure of the TRIP_4C domain of target of activating signal cointegrator 1
To be Published
2ECM
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BU of 2ecm by Molmil
Solution structure of the RING domain of the RING finger and CHY zinc finger domain-containing protein 1 from Mus musculus
Descriptor: RING finger and CHY zinc finger domain-containing protein 1, ZINC ION
Authors:Miyamoto, K, Yoneyama, M, Koshiba, S, Watanabe, S, Harada, T, Kigawa, T, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI)
Deposit date:2007-02-13
Release date:2007-08-14
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:Solution structure of the RING domain of the RING finger and CHY zinc finger domain-containing protein 1 from Mus musculus
To be Published
4D2G
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BU of 4d2g by Molmil
Crystal structure of human PCNA in complex with p15 peptide
Descriptor: P15, PROLIFERATING CELL NUCLEAR ANTIGEN
Authors:DeBiasio, A, Ibanez, A, Mortuza, G, Molina, R, Cordeiro, T.N, Castillo, F, Villate, M, Merino, N, Lelli, M, Diercks, T, Luque, I, Bernardo, P, Montoya, G, Blanco, F.J.
Deposit date:2014-05-09
Release date:2015-03-18
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Structure of P15(Paf)-PCNA Complex and Implications for Clamp Sliding During DNA Replication and Repair.
Nat.Commun., 6, 2015
4LZ2
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BU of 4lz2 by Molmil
Crystal structure of the bromodomain of human BAZ2A
Descriptor: 1,2-ETHANEDIOL, Bromodomain adjacent to zinc finger domain protein 2A, MAGNESIUM ION
Authors:Tallant, C, Nunez-Alonso, G, Picaud, S, Filippakopoulos, P, Krojer, T, Bradley, A, von Delft, F, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Knapp, S, Structural Genomics Consortium (SGC)
Deposit date:2013-07-31
Release date:2013-08-21
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:Molecular basis of histone tail recognition by human TIP5 PHD finger and bromodomain of the chromatin remodeling complex NoRC.
Structure, 23, 2015
1Q1V
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BU of 1q1v by Molmil
Structure of the Oncoprotein DEK: a putative DNA-binding Domain Related to the Winged Helix Motif
Descriptor: DEK protein
Authors:Devany, M, Kotharu, N.P, Matsuo, H.
Deposit date:2003-07-22
Release date:2004-08-10
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:Solution NMR structure of the C-terminal domain of the human protein DEK
PROTEIN SCI., 13, 2004
2CT2
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BU of 2ct2 by Molmil
Solution Structure of the RING domain of the Tripartite motif protein 32
Descriptor: Tripartite motif protein 32, ZINC ION
Authors:Miyamoto, K, Tochio, N, Sato, M, Koshiba, S, Inoue, M, Kigawa, T, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI)
Deposit date:2005-05-23
Release date:2005-11-23
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:Solution Structure of the RING domain of the Tripartite motif protein 32
To be Published
4DBB
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BU of 4dbb by Molmil
The PTB domain of Mint1 is autoinhibited by a helix in the C-terminal linker region
Descriptor: ACETIC ACID, Amyloid beta A4 precursor protein-binding family A member 1, CHLORIDE ION, ...
Authors:Tomchick, D.R, Rizo, J, Ho, A, Xu, Y.
Deposit date:2012-01-13
Release date:2012-03-07
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.901 Å)
Cite:Autoinhibition of Mint1 adaptor protein regulates amyloid precursor protein binding and processing.
Proc.Natl.Acad.Sci.USA, 109, 2012
7YTF
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BU of 7ytf by Molmil
Structure of OCPx2 from Nostoc flagelliforme CCNUN1
Descriptor: Ketosteroid isomerase-related protein, beta,beta-carotene-4,4'-dione
Authors:Yang, Y.W, Chen, S.Z, Liu, K, Chen, M, Qiu, B.S.
Deposit date:2022-08-14
Release date:2023-06-21
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Functional specialization of expanded orange carotenoid protein paralogs in subaerial Nostoc species.
Plant Physiol., 192, 2023
7YTH
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BU of 7yth by Molmil
Structure of OCPx1 from Nostoc flagelliforme CCNUN1
Descriptor: Ketosteroid isomerase-related protein
Authors:Yang, Y.W, Liu, K, Chen, S.Z, Chen, M, Qiu, B.S.
Deposit date:2022-08-14
Release date:2023-06-21
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.93 Å)
Cite:Functional specialization of expanded orange carotenoid protein paralogs in subaerial Nostoc species.
Plant Physiol., 192, 2023

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