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6J0I
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BU of 6j0i by Molmil
Structure of [Co2+-(Chromomycin A3)2]-d(TTGGCGAA)2 complex
Descriptor: 1,2-HYDRO-1-OXY-3,4-HYDRO-3-(1-METHOXY-2-OXY-3,4-DIHYDROXYPENTYL)-8,9-DIHYROXY-7-METHYLANTHRACENE, 2,6-dideoxy-4-O-methyl-alpha-D-galactopyranose-(1-3)-(2R,3R,6R)-6-hydroxy-2-methyltetrahydro-2H-pyran-3-yl acetate, 3-C-methyl-4-O-acetyl-alpha-L-Olivopyranose-(1-3)-(2R,5S,6R)-6-methyltetrahydro-2H-pyran-2,5-diol-(1-3)-(2R,5S,6R)-6-methyltetrahydro-2H-pyran-2,5-diol, ...
Authors:Satange, R.B, Chuang, C.Y, Hou, M.H.
Deposit date:2018-12-24
Release date:2019-07-24
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Polymorphic G:G mismatches act as hotspots for inducing right-handed Z DNA by DNA intercalation.
Nucleic Acids Res., 47, 2019
6J0H
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BU of 6j0h by Molmil
Crystal structure of Actinomycin D- d(TTGGCGAA) complex
Descriptor: Actinomycin D, DNA (5'-D(P*TP*TP*GP*GP*CP*GP*AP*A)-3'), SODIUM ION
Authors:Satange, R.B, Hou, M.H.
Deposit date:2018-12-24
Release date:2019-07-24
Last modified:2024-07-10
Method:X-RAY DIFFRACTION (1.52 Å)
Cite:Polymorphic G:G mismatches act as hotspots for inducing right-handed Z DNA by DNA intercalation.
Nucleic Acids Res., 47, 2019
5DWX
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BU of 5dwx by Molmil
Structural Insights into the Quadruplex-Duplex 3' Interface formed from a Telomeric Repeat - TLOOP
Descriptor: DNA (24-MER), DNA complementary strand, POTASSIUM ION
Authors:Parkinson, G.N, Russo Krauss, I.
Deposit date:2015-09-23
Release date:2016-01-20
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.71 Å)
Cite:Structural Insights into the Quadruplex-Duplex 3' Interface Formed from a Telomeric Repeat: A Potential Molecular Target.
J.Am.Chem.Soc., 138, 2016
5DWW
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BU of 5dww by Molmil
Structural Insights into the Quadruplex-Duplex 3' Interface formed from a Telomeric Repeat - TTLOOP
Descriptor: DNA (25-MER), DNA (5'-D(*TP*AP*AP*CP*GP*CP*TP*A)-3'), POTASSIUM ION
Authors:Russo Krauss, I, Parkinson, G.N.
Deposit date:2015-09-23
Release date:2016-01-20
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.79 Å)
Cite:Structural Insights into the Quadruplex-Duplex 3' Interface Formed from a Telomeric Repeat: A Potential Molecular Target.
J.Am.Chem.Soc., 138, 2016
5XEW
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BU of 5xew by Molmil
Crystal structure of the [Ni2+-(chromomycin A3)2]-CCG repeats complex
Descriptor: (1S)-5-deoxy-1-O-methyl-1-C-[(2R,3S)-3,5,7,10-tetrahydroxy-6-methyl-4-oxo-1,2,3,4-tetrahydroanthracen-2-yl]-D-xylulose, 2,6-dideoxy-4-O-methyl-alpha-D-galactopyranose-(1-3)-(2R,3R,6R)-6-hydroxy-2-methyltetrahydro-2H-pyran-3-yl acetate, 3-C-methyl-4-O-acetyl-alpha-L-Olivopyranose-(1-3)-(2R,5S,6R)-6-methyltetrahydro-2H-pyran-2,5-diol-(1-3)-(2R,5S,6R)-6-methyltetrahydro-2H-pyran-2,5-diol, ...
Authors:Tseng, W.H, Wu, P.C, Hou, M.H.
Deposit date:2017-04-06
Release date:2017-06-21
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (1.751 Å)
Cite:Induced-Fit Recognition of CCG Trinucleotide Repeats by a Nickel-Chromomycin Complex Resulting in Large-Scale DNA Deformation
Angew. Chem. Int. Ed. Engl., 56, 2017
7KLP
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BU of 7klp by Molmil
Crystal structure of a three-tetrad, parallel, K+ stabilized human telomeric G-quadruplex
Descriptor: HEXAETHYLENE GLYCOL, POTASSIUM ION, telomeric DNA
Authors:Yatsunyk, L.A, Li, K.S, Chen, E.V.
Deposit date:2020-10-30
Release date:2020-12-30
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:Water spines and networks in G-quadruplex structures.
Nucleic Acids Res., 49, 2021
4PZQ
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BU of 4pzq by Molmil
Crystal Structure of CCG DNA repeats
Descriptor: COBALT (II) ION, DNA (5'-D(*TP*CP*CP*GP*CP*CP*GP*CP*CP*GP*A)-3')
Authors:Chen, Y.W, Hou, M.H.
Deposit date:2014-03-31
Release date:2015-01-07
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.24 Å)
Cite:Structural basis for the identification of an i-motif tetraplex core with a parallel-duplex junction as a structural motif in CCG triplet repeats
Angew.Chem.Int.Ed.Engl., 53, 2014
6L75
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BU of 6l75 by Molmil
Crystal structure of d(GTGGGCCGAC)2 DNA duplex
Descriptor: DNA (5'-D(P*GP*TP*GP*GP*GP*CP*CP*GP*AP*C)-3')
Authors:Hou, M.H, Satange, R.B, Zeng, J.Y.
Deposit date:2019-10-31
Release date:2021-01-13
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.578 Å)
Cite:Targeting the ALS/FTD-associated A-DNA kink with anthracene-based metal complex causes DNA backbone straightening and groove contraction.
Nucleic Acids Res., 49, 2021
6L76
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BU of 6l76 by Molmil
Crystal structure of the Ni(II)(Chro)2-d(TTGGGCCGAA/TTCGGCCCAA) complex at 2.94 angstrom resolution
Descriptor: (1S)-5-deoxy-1-O-methyl-1-C-[(2R,3S)-3,5,7,10-tetrahydroxy-6-methyl-4-oxo-1,2,3,4-tetrahydroanthracen-2-yl]-D-xylulose, 2,6-dideoxy-4-O-methyl-alpha-D-galactopyranose-(1-3)-(2R,3R,6R)-6-hydroxy-2-methyltetrahydro-2H-pyran-3-yl acetate, 3-C-methyl-4-O-acetyl-alpha-L-Olivopyranose-(1-3)-(2R,5S,6R)-6-methyltetrahydro-2H-pyran-2,5-diol-(1-3)-(2R,5S,6R)-6-methyltetrahydro-2H-pyran-2,5-diol, ...
Authors:Hou, M.H, Jhan, C.R, Satange, R.B, Lin, S.M.
Deposit date:2019-10-31
Release date:2021-01-13
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.94 Å)
Cite:Targeting the ALS/FTD-associated A-DNA kink with anthracene-based metal complex causes DNA backbone straightening and groove contraction.
Nucleic Acids Res., 49, 2021
6XT7
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BU of 6xt7 by Molmil
Tel25 Hybrid Four-quartet G-quadruplex with K+
Descriptor: DNA (25-MER), MAGNESIUM ION, POTASSIUM ION, ...
Authors:Yatsunyk, L.A, McCarthy, S.E.
Deposit date:2020-07-17
Release date:2020-12-30
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.56 Å)
Cite:The first crystal structures of hybrid and parallel four-tetrad intramolecular G-quadruplexes.
Nucleic Acids Res., 50, 2022
7DQ8
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BU of 7dq8 by Molmil
Crystal structure of actinomycin D-echinomycin-d(ACGCGCT/AGCTCGT) complex
Descriptor: 2-CARBOXYQUINOXALINE, Actinomycin D, DNA (5'-D(P*AP*CP*GP*CP*GP*CP*T)-3'), ...
Authors:Satange, R.B, Hou, M.H.
Deposit date:2020-12-22
Release date:2021-12-29
Last modified:2024-07-10
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Synergistic binding of actinomycin D and echinomycin to DNA mismatch sites and their combined anti-tumour effects.
Nucleic Acids Res., 2023
7DQ0
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BU of 7dq0 by Molmil
Crystal structure of actinomycin D-echinomycin-d(ACGTGCT/AGCTCGT) complex
Descriptor: 2-CARBOXYQUINOXALINE, Actinomycin D, CHLORIDE ION, ...
Authors:Satange, R.B, Hou, M.H.
Deposit date:2020-12-22
Release date:2021-12-29
Last modified:2024-07-10
Method:X-RAY DIFFRACTION (2 Å)
Cite:Synergistic binding of actinomycin D and echinomycin to DNA mismatch sites and their combined anti-tumour effects.
Nucleic Acids Res., 2023
7BPV
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BU of 7bpv by Molmil
r(GUGGGCCGAC)/d(GTCGGCCCAC) hybrid duplex structure
Descriptor: DNA (5'-D(P*GP*TP*CP*GP*GP*CP*CP*CP*AP*C)-3'), RNA (5'-R(P*GP*UP*GP*GP*GP*CP*CP*GP*AP*C)-3'), SULFATE ION
Authors:Wang, S.C, Satange, R.B, Hou, M.H.
Deposit date:2020-03-23
Release date:2021-03-03
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.781 Å)
Cite:Targeting the ALS/FTD-associated A-DNA kink with anthracene-based metal complex causes DNA backbone straightening and groove contraction.
Nucleic Acids Res., 49, 2021
7X9F
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BU of 7x9f by Molmil
Crystal structure of actinomycin D-echinomycin-d(AGCGCGT/ACGCGCT) complex
Descriptor: 2-CARBOXYQUINOXALINE, DNA (5'-D(P*AP*CP*GP*CP*GP*CP*T)-3'), DNA (5'-D(P*AP*GP*CP*GP*CP*GP*T)-3'), ...
Authors:Kao, S.H, Satange, R.B, Hou, M.H.
Deposit date:2022-03-15
Release date:2022-12-14
Last modified:2024-07-10
Method:X-RAY DIFFRACTION (2.96 Å)
Cite:Staggered intercalation of DNA duplexes with base-pair modulation by two distinct drug molecules induces asymmetric backbone twisting and structure polymorphism.
Nucleic Acids Res., 50, 2022
7X6R
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BU of 7x6r by Molmil
Crystal structure of actinomycin D-echinomycin-d(AGCACGT/ACGGGCT) complex
Descriptor: 2-CARBOXYQUINOXALINE, Actinomycin D, COBALT (II) ION, ...
Authors:Kao, S.H, Satange, R.B, Hou, M.H.
Deposit date:2022-03-08
Release date:2022-12-14
Last modified:2024-07-10
Method:X-RAY DIFFRACTION (1.89 Å)
Cite:Staggered intercalation of DNA duplexes with base-pair modulation by two distinct drug molecules induces asymmetric backbone twisting and structure polymorphism.
Nucleic Acids Res., 50, 2022
7X97
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BU of 7x97 by Molmil
Crystal structure of actinomycin D-echinomycin-d(AGCCCGT/ACGGGCT) complex
Descriptor: 2-CARBOXYQUINOXALINE, Actinomycin D, CHLORIDE ION, ...
Authors:Kao, S.H, Satange, R.B, Hou, M.H.
Deposit date:2022-03-15
Release date:2022-12-14
Last modified:2024-07-10
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Staggered intercalation of DNA duplexes with base-pair modulation by two distinct drug molecules induces asymmetric backbone twisting and structure polymorphism.
Nucleic Acids Res., 50, 2022
7XDJ
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BU of 7xdj by Molmil
Crystal structure of actinomycin D-echinomycin-d(AGCGCGT/ACGAGCT) complex
Descriptor: 2-CARBOXYQUINOXALINE, CHLORIDE ION, DNA (5'-D(P*AP*CP*GP*AP*GP*CP*(BRU))-3'), ...
Authors:Chien, C.M, Satange, R.B, Hou, M.H.
Deposit date:2022-03-27
Release date:2022-12-14
Last modified:2024-07-10
Method:X-RAY DIFFRACTION (2.435 Å)
Cite:Staggered intercalation of DNA duplexes with base-pair modulation by two distinct drug molecules induces asymmetric backbone twisting and structure polymorphism.
Nucleic Acids Res., 50, 2022
4E68
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BU of 4e68 by Molmil
Unphosphorylated STAT3B core protein binding to dsDNA
Descriptor: DNA (5'-D(*TP*GP*CP*AP*TP*TP*TP*CP*CP*CP*GP*TP*AP*AP*AP*TP*CP*T)-3'), Signal transducer and activator of transcription 3
Authors:Collie, G.W, Parkinson, G.N, Shah, R.
Deposit date:2012-03-15
Release date:2013-03-06
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.585 Å)
Cite:Observation of unphosphorylated STAT3 core protein binding to target dsDNA by PEMSA and X-ray crystallography.
Febs Lett., 587, 2013
5ZT2
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BU of 5zt2 by Molmil
Crystal structure of CCG DNA repeats at 1.66 angstrom resolution
Descriptor: COBALT (II) ION, DNA (5'-D(*TP*CP*CP*GP*CP*CP*GP*CP*CP*GP*A)-3')
Authors:Hou, M.H, Wu, P.C, Satange, R.B, Chen, Y.W.
Deposit date:2018-05-01
Release date:2019-05-15
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (1.66002166 Å)
Cite:Crystallographic analysis of conformational change in CCG repeats into i-motif and unusual DNA duplex in presence and absence of CoII(Chro)2 complex
To Be Published
8FDP
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BU of 8fdp by Molmil
The native structure of a dodecamer: 5'-CGCAAATTTGCG-3
Descriptor: DNA (5'-D(*CP*GP*CP*AP*AP*AP*TP*TP*TP*GP*CP*G)-3')
Authors:Ogbonna, E, Wilson, W.D.
Deposit date:2022-12-04
Release date:2023-02-22
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:X-ray Structure Characterization of the Selective Recognition of AT Base Pair Sequences.
Acs Bio Med Chem Au, 3, 2023
8FDQ
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BU of 8fdq by Molmil
An AT-specific DNA 5-CGCAAATTTCGC-3' with benzimidazole (DB1476) complex
Descriptor: 4,4'-(1H-benzimidazole-2,6-diyl)di(benzene-1-carboximidamide), DNA (5'-D(*CP*GP*CP*AP*AP*AP*TP*TP*TP*GP*CP*G)-3'), MAGNESIUM ION
Authors:Ogboona, E.N, Wilson, W.D.
Deposit date:2022-12-04
Release date:2023-02-22
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.54 Å)
Cite:X-ray Structure Characterization of the Selective Recognition of AT Base Pair Sequences.
Acs Bio Med Chem Au, 3, 2023
3T5E
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BU of 3t5e by Molmil
Crystal structure of an intramolecular human telomeric DNA G-quadruplex bound by the naphthalene diimide BMSG-SH-4
Descriptor: 2,7-bis[4-(4-methylpiperazin-1-yl)butyl]-4,9-bis{[4-(4-methylpiperazin-1-yl)butyl]amino}benzo[lmn][3,8]phenanthroline-1 ,3,6,8(2H,7H)-tetrone, POTASSIUM ION, human telomeric DNA sequence
Authors:Collie, G.W, Promontorio, R, Parkinson, G.N.
Deposit date:2011-07-27
Release date:2012-02-15
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structural basis for telomeric g-quadruplex targeting by naphthalene diimide ligands.
J.Am.Chem.Soc., 134, 2012
3SC8
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BU of 3sc8 by Molmil
Crystal structure of an intramolecular human telomeric DNA G-quadruplex bound by the naphthalene diimide BMSG-SH-3
Descriptor: 2,7-bis[3-(4-methylpiperazin-1-yl)propyl]-4,9-bis{[3-(4-methylpiperazin-1-yl)propyl]amino}benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetrone, Human telomeric repeat sequence, POTASSIUM ION
Authors:Collie, G.W, Promontorio, R, Parkinson, G.N.
Deposit date:2011-06-07
Release date:2012-02-15
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.302 Å)
Cite:Structural basis for telomeric g-quadruplex targeting by naphthalene diimide ligands.
J.Am.Chem.Soc., 134, 2012
8XPB
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BU of 8xpb by Molmil
Crystal structure of d(ACGCCGT/ACGGCGT) in complex with Echinomycin
Descriptor: 2-CARBOXYQUINOXALINE, DNA (5'-D(P*AP*CP*GP*CP*CP*GP*T)-3'), DNA (5'-D(P*AP*CP*GP*GP*CP*GP*T)-3'), ...
Authors:Hou, M.H, Huang, H.T, Lin, S.M, Neidle, S.
Deposit date:2024-01-03
Release date:2024-05-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal structure of d(ACGCCGT/ACGGCGT) in complex with Echinomycin
To Be Published
8XP9
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BU of 8xp9 by Molmil
Crystal structure of d(ACGCCGT/ACGGCGT)
Descriptor: DNA (5'-D(P*AP*CP*GP*CP*CP*GP*T)-3'), DNA (5'-D(P*AP*CP*GP*GP*CP*GP*T)-3')
Authors:Hou, M.H, Lin, S.M, Lin, Y.J, Neidle, S.
Deposit date:2024-01-03
Release date:2024-05-29
Method:X-RAY DIFFRACTION (2.34 Å)
Cite:Crystal structure of d(ACGCCGT/ACGGCGT)
To Be Published

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