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4MTC
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BU of 4mtc by Molmil
Crystal structure of human C53A DJ-1
Descriptor: 1,2-ETHANEDIOL, Protein DJ-1
Authors:Cendron, L, Girotto, S, Bisaglia, M, Tessari, I, Mammi, S, Zanotti, G, Bubacco, L.
Deposit date:2013-09-19
Release date:2014-03-05
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.47 Å)
Cite:DJ-1 Is a Copper Chaperone Acting on SOD1 Activation.
J.Biol.Chem., 289, 2014
3OBH
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BU of 3obh by Molmil
X-ray crystal structure of protein SP_0782 (7-79) from Streptococcus pneumoniae. Northeast Structural Genomics Consortium Target SpR104
Descriptor: ACETIC ACID, CITRIC ACID, DI(HYDROXYETHYL)ETHER, ...
Authors:Kuzin, A, Abashidze, M, Lew, S, Seetharaman, J, Patel, P, Xiao, R, Ciccosanti, C, Lee, D, Everett, J.K, Nair, R, Acton, T.B, Rost, B, Montelione, G.T, Tong, L, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
Deposit date:2010-08-06
Release date:2010-09-15
Last modified:2012-02-22
Method:X-RAY DIFFRACTION (1.891 Å)
Cite:X-ray crystal structure of protein SP_0782 (7-79) from Streptococcus pneumoniae. Northeast Structural Genomics Consortium Target SpR104
To be Published
1OIR
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BU of 1oir by Molmil
Imidazopyridines: a potent and selective class of Cyclin-dependent Kinase inhibitors identified through Structure-based hybridisation
Descriptor: 1-(DIMETHYLAMINO)-3-(4-{{4-(2-METHYLIMIDAZO[1,2-A]PYRIDIN-3-YL)PYRIMIDIN-2-YL]AMINO}PHENOXY)PROPAN-2-OL, CELL DIVISION PROTEIN KINASE 2
Authors:Beattie, J.F, Breault, G.A, Byth, K.F, Culshaw, J.D, Ellston, R.P.A, Green, S, Minshull, C.A, Norman, R.A, Pauptit, R.A, Thomas, A.P, Jewsbury, P.J.
Deposit date:2003-06-24
Release date:2003-09-04
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.91 Å)
Cite:Imidazo[1,2-A]Pyridines: A Potent and Selective Class of Cyclin-Dependent Kinase Inhibitors Identified Through Structure-Based Hybridisation
Bioorg.Med.Chem.Lett., 13, 2003
5APZ
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BU of 5apz by Molmil
Thermosinus carboxydivorans Nor1 Tcar0761 residues 68-101 and 191-211 fused to GCN4 adaptors
Descriptor: GENERAL CONTROL PROTEIN GCN4, NOR1 TCAR0761
Authors:Hartmann, M.D, Deiss, S, Lupas, A.N, Hernandez Alvarez, B.
Deposit date:2015-09-17
Release date:2016-01-27
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:alpha / beta coiled coils.
Elife, 5, 2016
1PXL
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BU of 1pxl by Molmil
HUMAN CYCLIN DEPENDENT KINASE 2 COMPLEXED WITH THE INHIBITOR [4-(2,4-Dimethyl-thiazol-5-yl)-pyrimidin-2-yl]-(4-trifluoromethyl-phenyl)-amine
Descriptor: 4-(2,4-DIMETHYL-1,3-THIAZOL-5-YL)-N-[4-(TRIFLUOROMETHYL)PHENYL]PYRIMIDIN-2-AMINE, Cell division protein kinase 2
Authors:Wu, S.Y, McNae, I, Kontopidis, G, McClue, S.J, McInnes, C, Stewart, K.J, Wang, S, Zheleva, D.I, Marriage, H, Lane, D.P, Taylor, P, Fischer, P.M, Walkinshaw, M.D.
Deposit date:2003-07-04
Release date:2003-12-09
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Discovery of a novel family of CDK inhibitors with the program LIDAEUS: structural basis for ligand-induced disordering of the activation loop
Structure, 11, 2003
5APW
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BU of 5apw by Molmil
Sequence MATKDD inserted between GCN4 adaptors - Structure T6
Descriptor: CALCIUM ION, CHLORIDE ION, GENERAL CONTROL PROTEIN GCN4, ...
Authors:Hartmann, M.D, Mendler, C.T, Lupas, A.N, Hernandez Alvarez, B.
Deposit date:2015-09-17
Release date:2016-01-27
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:alpha / beta coiled coils.
Elife, 5, 2016
5APX
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BU of 5apx by Molmil
Sequence MATKDDIAN inserted between GCN4 adaptors - Structure T9(6)
Descriptor: GENERAL CONTROL PROTEIN GCN4, PHOSPHATE ION
Authors:Hartmann, M.D, Mendler, C.T, Lupas, A.N, Hernandez Alvarez, B.
Deposit date:2015-09-17
Release date:2016-01-27
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:alpha / beta coiled coils.
Elife, 5, 2016
1GCM
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BU of 1gcm by Molmil
GCN4 LEUCINE ZIPPER CORE MUTANT P-LI
Descriptor: GCN4P-II
Authors:Harbury, P.B, Kim, P.S, Alber, T.
Deposit date:1995-04-25
Release date:1996-01-29
Last modified:2021-11-03
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure of an isoleucine-zipper trimer.
Nature, 371, 1994
4OQ4
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BU of 4oq4 by Molmil
Crystal Structure of E18A Human DJ-1
Descriptor: Protein DJ-1, SODIUM ION
Authors:Prahlad, J, Hauser, D.N, Milkovic, N.M, Cookson, M.R, Wilson, M.A.
Deposit date:2014-02-07
Release date:2014-02-19
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.49 Å)
Cite:Use of cysteine-reactive cross-linkers to probe conformational flexibility of human DJ-1 demonstrates that Glu18 mutations are dimers.
J Neurochem, 130, 2014
7WJG
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BU of 7wjg by Molmil
Streptococcus mutans BusR transcriptional factor
Descriptor: CITRIC ACID, Putative transcriptional regulator (GntR family)
Authors:Li, X, Liu, N.
Deposit date:2022-01-06
Release date:2023-01-11
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (2.42 Å)
Cite:Structural study of transcriptional factor BusR
To Be Published
3VBX
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BU of 3vbx by Molmil
Exploitation of hydrogen bonding constraints and flat hydrophobic energy landscapes in Pim-1 kinase needle screening and inhibitor design
Descriptor: 6-bromo-4-hydroxy-2H-chromen-2-one, Serine/threonine-protein kinase pim-1
Authors:Liu, J.
Deposit date:2012-01-02
Release date:2012-03-21
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.03 Å)
Cite:Implications of promiscuous Pim-1 kinase fragment inhibitor hydrophobic interactions for fragment-based drug design.
J.Med.Chem., 55, 2012
3WKV
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BU of 3wkv by Molmil
Voltage-gated proton channel: VSOP/Hv1 chimeric channel
Descriptor: Ion channel
Authors:Takeshita, K, Sakata, S, Yamashita, E, Fujiwara, Y, Kawanabe, A, Kurokawa, T, Okochi, Y, Matsuda, M, Narita, H, Okamura, Y, Nakagawa, A.
Deposit date:2013-10-31
Release date:2014-03-05
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (3.453 Å)
Cite:X-ray crystal structure of voltage-gated proton channel.
Nat.Struct.Mol.Biol., 21, 2014
4P34
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BU of 4p34 by Molmil
Crystal structure of DJ-1 in sulfenic acid form (fresh crystal)
Descriptor: PENTAETHYLENE GLYCOL, Protein DJ-1
Authors:Tashiro, S, Wu, C.-X, Hoang, Q.Q, Caaveiro, J.M.M, Tsumoto, K.
Deposit date:2014-03-05
Release date:2014-04-09
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Thermodynamic and Structural Characterization of the Specific Binding of Zn(II) to Human Protein DJ-1.
Biochemistry, 53, 2014
5E57
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BU of 5e57 by Molmil
Crystal structure of Mycobacterium smegmatis AmtR
Descriptor: ACETATE ION, Transcription regulator AmtR
Authors:Vickers, C.J, McKenzie, J.L, Arcus, V.L.
Deposit date:2015-10-07
Release date:2016-09-28
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.98 Å)
Cite:Structure and Function of AmtR in Mycobacterium smegmatis: Implications for Post-Transcriptional Regulation of Urea Metabolism through a Small Antisense RNA.
J.Mol.Biol., 428, 2016
1GCL
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BU of 1gcl by Molmil
GCN4 LEUCINE ZIPPER CORE MUTANT P-LI
Descriptor: GCN4
Authors:Harbury, P.B, Zhang, T, Kim, P.S, Alber, T.
Deposit date:1993-10-20
Release date:1995-06-03
Last modified:2024-06-05
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:A switch between two-, three-, and four-stranded coiled coils in GCN4 leucine zipper mutants.
Science, 262, 1993
3NSP
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BU of 3nsp by Molmil
Crystal structure of tetrameric RXRalpha-LBD
Descriptor: Retinoid X receptor, alpha
Authors:Zhang, H, Hu, T, Li, L, Zhou, R, Chen, L, Hu, L, Jiang, H, Shen, X.
Deposit date:2010-07-02
Release date:2010-11-17
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Danthron functions as a retinoic X receptor antagonist by stabilizing tetramers of the receptor.
J.Biol.Chem., 286, 2011
3O1E
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BU of 3o1e by Molmil
Structure-function of Gemini derivatives with two different side chains at C-20, Gemini-0072 and Gemini-0097.
Descriptor: (1R,3R,7E,17beta)-17-[(1R)-6,6,6-trifluoro-5-hydroxy-1-(4-hydroxy-4-methylpentyl)-5-(trifluoromethyl)hex-3-yn-1-yl]-9,1 0-secoestra-5,7-diene-1,3-diol, Nuclear receptor coactivator 2, Vitamin D3 receptor A
Authors:Huet, T, Moras, D, Rochel, N.
Deposit date:2010-07-21
Release date:2011-07-06
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.5001 Å)
Cite:Structure-function study of gemini derivatives with two different side chains at C-20, Gemini-0072 and Gemini-0097.
Medchemcomm, 2, 2011
3TQN
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BU of 3tqn by Molmil
Structure of the transcriptional regulator of the GntR family, from Coxiella burnetii.
Descriptor: Transcriptional regulator, GntR family
Authors:Rudolph, M, Cheung, J, Franklin, M.C, Cassidy, M, Gary, E, Burshteyn, F, Love, J.
Deposit date:2011-09-09
Release date:2011-09-28
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
7W5Z
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BU of 7w5z by Molmil
Cryo-EM structure of Tetrahymena thermophila mitochondrial complex IV, composite dimer model
Descriptor: 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 2-oxoglutarate/malate carrier protein, CARDIOLIPIN, ...
Authors:Zhou, L, Maldonado, M, Padavannil, A, Letts, J.
Deposit date:2021-11-30
Release date:2022-04-06
Last modified:2022-06-01
Method:ELECTRON MICROSCOPY (3.02 Å)
Cite:Structures of Tetrahymena 's respiratory chain reveal the diversity of eukaryotic core metabolism.
Science, 376, 2022
3NPI
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BU of 3npi by Molmil
Crystal structure of a TetR family regulatory protein (DIP1788) from CORYNEBACTERIUM DIPHTHERIAE at 2.96 A resolution
Descriptor: SULFATE ION, TetR family regulatory protein
Authors:Joint Center for Structural Genomics (JCSG)
Deposit date:2010-06-28
Release date:2010-08-18
Last modified:2023-02-01
Method:X-RAY DIFFRACTION (2.96 Å)
Cite:Crystal structure of a TetR family regulatory protein (DIP1788) from CORYNEBACTERIUM DIPHTHERIAE at 2.96 A resolution
To be published
3NRW
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BU of 3nrw by Molmil
Crystal Structure of the N-terminal domain of Phage integrase/site-specific recombinase (tnp) from Haloarcula marismortui, Northeast Structural Genomics Consortium Target HmR208A
Descriptor: Phage integrase/site-specific recombinase
Authors:Forouhar, F, Su, M, Seetharaman, J, Mao, M, Xiao, R, Ciccosanti, C, Wang, D, Everett, J.K, Nair, R, Acton, T.B, Rost, B, Montelione, G.T, Tong, L, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
Deposit date:2010-06-30
Release date:2010-08-25
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Northeast Structural Genomics Consortium Target HmR208A
To be Published
4H9O
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BU of 4h9o by Molmil
Complex structure 2 of DAXX/H3.3(sub5,G90M)/H4
Descriptor: Death domain-associated protein 6, Histone H3.3, Histone H4, ...
Authors:Elsasser, S.J, Huang, H, Lewis, P.W, Chin, J.W, Allis, D.C, Patel, D.J.
Deposit date:2012-09-24
Release date:2012-10-10
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.053 Å)
Cite:DAXX chaperone envelops an H3.3/H4 dimer dictating H3.3-specific read out
To be Published
4H9R
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BU of 4h9r by Molmil
Complex structure 5 of DAXX(E225A)/H3.3(sub5,G90A)/H4
Descriptor: Death domain-associated protein 6, Histone H3.3, Histone H4, ...
Authors:Elsasser, S.J, Huang, H, Lewis, P.W, Chin, J.W, Allis, D.C, Patel, D.J.
Deposit date:2012-09-24
Release date:2012-10-17
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.197 Å)
Cite:DAXX chaperone envelops an H3.3/H4 dimer dictating H3.3-specific read out
To be Published
4H9S
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BU of 4h9s by Molmil
Complex structure 6 of DAXX/H3.3(sub7)/H4
Descriptor: Death domain-associated protein 6, Histone H3.3, Histone H4, ...
Authors:Elsasser, S.J, Huang, H, Lewis, P.W, Chin, J.W, Allis, D.C, Patel, D.J.
Deposit date:2012-09-24
Release date:2012-10-17
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:DAXX chaperone envelops an H3.3/H4 dimer dictating H3.3-specific read out
To be Published
1EBO
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BU of 1ebo by Molmil
CRYSTAL STRUCTURE OF THE EBOLA VIRUS MEMBRANE-FUSION SUBUNIT, GP2, FROM THE ENVELOPE GLYCOPROTEIN ECTODOMAIN
Descriptor: CHLORIDE ION, EBOLA VIRUS ENVELOPE PROTEIN CHIMERA CONSISTING OF A FRAGMENT OF GCN4 ZIPPER CLONED N-TERMINAL TO A FRAGMENT OF GP2, ZINC ION
Authors:Weissenhorn, W, Carfi, A, Lee, K.H, Skehel, J.J, Wiley, D.C.
Deposit date:1998-11-03
Release date:1999-07-02
Last modified:2022-12-21
Method:X-RAY DIFFRACTION (3 Å)
Cite:Crystal structure of the Ebola virus membrane fusion subunit, GP2, from the envelope glycoprotein ectodomain.
Mol.Cell, 2, 1998

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