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6CC0
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BU of 6cc0 by Molmil
Crystal structure of QscR bound to C12-homoserine lactone
Descriptor: LuxR family transcriptional regulator, N-[(3S)-2-oxooxolan-3-yl]dodecanamide
Authors:Churchill, M.E.A, Wysoczynski-Horita, C.L.
Deposit date:2018-02-05
Release date:2018-02-28
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Mechanism of agonism and antagonism of the Pseudomonas aeruginosa quorum sensing regulator QscR with non-native ligands.
Mol. Microbiol., 108, 2018
5J4L
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BU of 5j4l by Molmil
Apo-structure of humanised RadA-mutant humRadA22F
Descriptor: CHLORIDE ION, DNA repair and recombination protein RadA
Authors:Fischer, G, Marsh, M, Moschetti, T, Sharpe, T, Scott, D, Morgan, M, Ng, H, Skidmore, J, Venkitaraman, A, Abell, C, Blundell, T.L, Hyvonen, M.
Deposit date:2016-04-01
Release date:2016-10-19
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (1.13 Å)
Cite:Engineering Archeal Surrogate Systems for the Development of Protein-Protein Interaction Inhibitors against Human RAD51.
J.Mol.Biol., 428, 2016
5JEE
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BU of 5jee by Molmil
Apo-structure of humanised RadA-mutant humRadA26F
Descriptor: CALCIUM ION, DNA repair and recombination protein RadA
Authors:Fischer, G, Marsh, M, Moschetti, T, Sharpe, T, Scott, D, Morgan, M, Ng, H, Skidmore, J, Venkitaraman, A, Abell, C, Blundell, T.L, Hyvonen, M.
Deposit date:2016-04-18
Release date:2016-10-19
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.49 Å)
Cite:Engineering Archeal Surrogate Systems for the Development of Protein-Protein Interaction Inhibitors against Human RAD51.
J.Mol.Biol., 428, 2016
5JFG
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BU of 5jfg by Molmil
Structure of humanised RadA-mutant humRadA22F in complex with peptide FHTA
Descriptor: CALCIUM ION, DIMETHYL SULFOXIDE, DNA repair and recombination protein RadA, ...
Authors:Fischer, G, Marsh, M, Moschetti, T, Sharpe, T, Scott, D, Morgan, M, Ng, H, Skidmore, J, Venkitaraman, A, Abell, C, Blundell, T.L, Hyvonen, M.
Deposit date:2016-04-19
Release date:2016-10-26
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:Humanisation of RadA from Pyrococcus furiosus
To Be Published
2EXS
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BU of 2exs by Molmil
TRAP3 (engineered TRAP)
Descriptor: TRYPTOPHAN, Transcription attenuation protein mtrB
Authors:Heddle, J.G, Yokoyama, T, Yamashita, I, Park, S.Y, Tame, J.R.H.
Deposit date:2005-11-08
Release date:2006-08-01
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Rounding up: Engineering 12-Membered Rings from the Cyclic 11-Mer TRAP
Structure, 14, 2006
3HL8
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BU of 3hl8 by Molmil
Crystal structure of exonuclease I in complex with inhibitor BCBP
Descriptor: (5R)-3-tert-butyl-1-(6-chloro-1,3-benzothiazol-2-yl)-4,5-dihydro-1H-pyrazol-5-ol, 1,2-ETHANEDIOL, DIMETHYL SULFOXIDE, ...
Authors:Satyshur, K.A.
Deposit date:2009-05-27
Release date:2010-01-19
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Small-molecule tools for dissecting the roles of SSB/protein interactions in genome maintenance
Proc.Natl.Acad.Sci.USA, 107, 2010
4QYG
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BU of 4qyg by Molmil
CHK1 kinase domain in complex with diazacarbazole compound 14
Descriptor: 3-[4-(4-methylpiperazin-1-yl)phenyl]-9H-pyrrolo[2,3-b:5,4-c']dipyridine-6-carboxylic acid, Serine/threonine-protein kinase Chk1
Authors:Wiesmann, C, Wu, P.
Deposit date:2014-07-24
Release date:2014-12-17
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Discovery of the 1,7-diazacarbazole class of inhibitors of checkpoint kinase 1.
Bioorg.Med.Chem.Lett., 24, 2014
2EXT
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BU of 2ext by Molmil
TRAP4 (engineered TRAP)
Descriptor: TRYPTOPHAN, Transcription attenuation protein mtrB
Authors:Heddle, J.G, Yokoyama, T, Yamashita, I, Park, S.Y, Tame, J.R.H.
Deposit date:2005-11-08
Release date:2006-08-01
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Rounding up: Engineering 12-Membered Rings from the Cyclic 11-Mer TRAP
Structure, 14, 2006
4GCV
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BU of 4gcv by Molmil
Structure of a Putative transcription factor (PA1374)from Pseudomonas aeruginosa
Descriptor: GLYCEROL, PHOSPHATE ION, Putative transcription protein, ...
Authors:Choe, J, Kim, H.
Deposit date:2012-07-31
Release date:2013-07-24
Last modified:2013-07-31
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:The X-ray crystal structure of PA1374 from Pseudomonas aeruginosa, a putative oxidative-stress sensing transcriptional regulator.
Biochem.Biophys.Res.Commun., 431, 2013
4JBZ
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BU of 4jbz by Molmil
Structure of Mcm10 coiled-coil region
Descriptor: MALTOSE-BINDING PERIPLASMIC PROTEIN FUSED WITH XENOPUS LAEVIS MCM10 COILED-COIL REGION, alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose
Authors:Du, W, Adhikary, S, Eichman, B.F.
Deposit date:2013-02-20
Release date:2013-12-11
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Mcm10 self-association is mediated by an N-terminal coiled-coil domain.
Plos One, 8, 2013
1MXJ
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BU of 1mxj by Molmil
NMR solution structure of benz[a]anthracene-dG in ras codon 12,2; GGCAGXTGGTG
Descriptor: 1S,2R,3S,4R-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL, 5'-D(*CP*AP*CP*CP*AP*CP*CP*TP*GP*CP*C)-3', 5'-D(*GP*GP*CP*AP*GP*GP*TP*GP*GP*TP*G)-3'
Authors:Kim, H.-Y.H, Wilkinson, A.S, Harris, C.M, Harris, T.M, Stone, M.P.
Deposit date:2002-10-02
Release date:2003-03-11
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Minor Groove Orientation for the (1S,2R,3S,4R)-N2-[1-(1,2,3,4-tetrahydro-2,3,4-trihydroxy-benz[a]anthracenyl)]-2'-deoxyguanosyl Adduct in the N-ras Codon 12 sequence
Biochemistry, 42, 2003
4ZHN
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BU of 4zhn by Molmil
Crystal Structure of AlkB T208A mutant protein in complex with Co(II), 2-oxoglutarate, and methylated trinucleotide T-meA-T
Descriptor: 2-OXOGLUTARIC ACID, Alpha-ketoglutarate-dependent dioxygenase AlkB, COBALT (II) ION, ...
Authors:Ergel, B, Yu, B, Vorobiev, S.M, Forouhar, F, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
Deposit date:2015-04-25
Release date:2015-12-23
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.333 Å)
Cite:DFT Studies of the Rate-Limiting Step in the Reaction Cycle of the Fe/2OG Dioxygenase AlkB and Related Experimental Studies
To be published
4CDN
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BU of 4cdn by Molmil
Crystal structure of M. mazei photolyase with its in vivo reconstituted 8-HDF antenna chromophore
Descriptor: 1-deoxy-1-(8-hydroxy-2,4-dioxo-3,4-dihydropyrimido[4,5-b]quinolin-10(2H)-yl)-D-ribitol, DEOXYRIBODIPYRIMIDINE PHOTOLYASE, DI(HYDROXYETHYL)ETHER, ...
Authors:Kiontke, S, Batschauer, A, Essen, L.-O.
Deposit date:2013-11-01
Release date:2014-05-21
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structural and Evolutionary Aspects of Antenna Chromophore Usage by Class II Photolyases.
J.Biol.Chem., 289, 2014
4Z58
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BU of 4z58 by Molmil
HipB-O3 20mer complex
Descriptor: Antitoxin HipB, DNA (5'-D(*TP*TP*AP*TP*CP*CP*GP*CP*TP*CP*TP*AP*CP*GP*GP*GP*AP*TP*AP*A)-3')
Authors:Min, J, Brennan, R.G, Schumacher, M.A.
Deposit date:2015-04-02
Release date:2016-07-06
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Molecular mechanism on hipBA gene regulation.
To be published
8CEZ
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BU of 8cez by Molmil
HK97 Portal Protein In situ (prohead II)
Descriptor: Portal protein
Authors:Hawkins, D.E.D.P, Antson, A.A.
Deposit date:2023-02-02
Release date:2023-05-24
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (2.97 Å)
Cite:Insights into a viral motor: the structure of the HK97 packaging termination assembly.
Nucleic Acids Res., 51, 2023
2YPY
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BU of 2ypy by Molmil
KSHV LANA (ORF73) C-terminal domain, decameric ring: monoclinic crystal form
Descriptor: CHLORIDE ION, ORF 73
Authors:Hellert, J, Krausze, J, Luhrs, T.
Deposit date:2012-11-02
Release date:2013-11-13
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.453 Å)
Cite:A Structural Basis for Brd2/4-Mediated Host Chromatin Interaction and Oligomer Assembly of Kaposi Sarcoma-Associated Herpesvirus and Murine Gammaherpesvirus Lana Proteins.
Plos Pathog., 9, 2013
6J8W
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BU of 6j8w by Molmil
Structure of MOEN5-SSO7D fusion protein in complex with lig 1
Descriptor: (2S)-3-dimethoxyphosphoryloxy-2-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]propanoic acid, MoeN5,DNA-binding protein 7d
Authors:Ko, T.P, Zhang, L.L, Chen, C.C, Guo, R.T.
Deposit date:2019-01-21
Release date:2019-04-17
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Complex structures of MoeN5 with substrate analogues suggest sequential catalytic mechanism.
Biochem. Biophys. Res. Commun., 511, 2019
4HV0
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BU of 4hv0 by Molmil
Structure and Function of AvtR, a Novel Transcriptional Regulator from a Hyperthermophilic Archaeal Lipothrixvirus
Descriptor: AvtR
Authors:Peixeiro, N, Keller, J, Collinet, B, Leulliot, N, Campanacci, V, Cortez, D, Cambillau, C, Nitta, K.R, Vincentelli, R, Forterre, P, Prangishvili, D, Sezonov, G, van Tilbeurgh, H.
Deposit date:2012-11-05
Release date:2012-11-21
Last modified:2012-12-26
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structure and Function of AvtR, a Novel Transcriptional Regulator from a Hyperthermophilic Archaeal Lipothrixvirus.
J.Virol., 87, 2013
2IYN
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BU of 2iyn by Molmil
The co-factor-induced pre-active conformation in PhoB
Descriptor: MAGNESIUM ION, PHOSPHATE REGULON TRANSCRIPTIONAL REGULATORY PROTEIN PHOB
Authors:Sola, M, Drew, D.L, Blanco, A.G, Gomis-Ruth, F.X, Coll, M.
Deposit date:2006-07-19
Release date:2006-08-30
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.08 Å)
Cite:The Cofactor-Induced Pre-Active Conformation in Phob.
Acta Crystallogr.,Sect.D, 62, 2006
5A0W
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BU of 5a0w by Molmil
THE CRYSTAL STRUCTURE OF I-DMOI E117A IN COMPLEX WITH ITS TARGET DNA AND IN THE PRESENCE OF 2MM MN
Descriptor: 25MER, ACETATE ION, CHLORIDE ION, ...
Authors:Molina, R, Besker, N, Prieto, J, Montoya, G, D'Abramo, M.
Deposit date:2015-04-23
Release date:2016-05-11
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural and Dynamical Characterization of the I- Dmo Catalytic Activity
To be Published
8J09
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BU of 8j09 by Molmil
Crystal structure of protein 3745
Descriptor: Cell division control protein 45, DNA replication regulator SLD3
Authors:Li, H, Yao, M.
Deposit date:2023-04-10
Release date:2024-05-29
Method:X-RAY DIFFRACTION (2.61 Å)
Cite:Structural and functional insights into a process of complex formation by 3745
To Be Published
2YQ0
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BU of 2yq0 by Molmil
KSHV LANA (ORF73) C-terminal domain, octameric ring: cubic crystal form
Descriptor: ORF 73, SULFATE ION
Authors:Hellert, J, Krausze, J, Luhrs, T.
Deposit date:2012-11-02
Release date:2013-11-13
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (3.911 Å)
Cite:A Structural Basis for Brd2/4-Mediated Host Chromatin Interaction and Oligomer Assembly of Kaposi Sarcoma-Associated Herpesvirus and Murine Gammaherpesvirus Lana Proteins.
Plos Pathog., 9, 2013
2YPZ
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BU of 2ypz by Molmil
KSHV LANA (ORF73) C-terminal domain, decameric ring: orthorhombic crystal form
Descriptor: KSHV LANA
Authors:Hellert, J, Krausze, J, Luhrs, T.
Deposit date:2012-11-02
Release date:2013-11-13
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (3.199 Å)
Cite:A Structural Basis for Brd2/4-Mediated Host Chromatin Interaction and Oligomer Assembly of Kaposi Sarcoma-Associated Herpesvirus and Murine Gammaherpesvirus Lana Proteins.
Plos Pathog., 9, 2013
2YQ1
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BU of 2yq1 by Molmil
MHV-68 LANA (ORF73) C-terminal domain: triclinic crystal form
Descriptor: ORF73
Authors:Hellert, J, Krausze, J, Luhrs, T.
Deposit date:2012-11-02
Release date:2013-11-13
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:A Structural Basis for Brd2/4-Mediated Host Chromatin Interaction and Oligomer Assembly of Kaposi Sarcoma-Associated Herpesvirus and Murine Gammaherpesvirus Lana Proteins.
Plos Pathog., 9, 2013
6ZSG
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BU of 6zsg by Molmil
Human mitochondrial ribosome in complex with mRNA, A-site tRNA, P-site tRNA and E-site tRNA
Descriptor: 12S mitochondrial rRNA, 16S mitochondrial rRNA, 28S ribosomal protein S10, ...
Authors:Aibara, S, Singh, V, Modelska, A, Amunts, A.
Deposit date:2020-07-15
Release date:2020-10-14
Last modified:2024-07-10
Method:ELECTRON MICROSCOPY (4 Å)
Cite:Structural basis of mitochondrial translation.
Elife, 9, 2020

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