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1K2L
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BU of 1k2l by Molmil
STRUCTURAL CHARACTERIZATION OF BISINTERCALATION IN HIGHER-ORDER DNA AT A JUNCTION-LIKE QUADRUPLEX
Descriptor: 5'-D(*CP*GP*TP*AP*CP*G)-3', BIS-(9-OCTYLAMINO(2-DIMETHYLAMINOETHYL)ACRIDINE-4-CARBOXAMIDE, COBALT (II) ION
Authors:Teixeira, S.C.M, Thorpe, J.H, Todd, A.K, Powell, H.R, Adams, A, Wakelin, L.P.G, Denny, W.A, Cardin, C.J.
Deposit date:2001-09-28
Release date:2002-10-16
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structural Characterisation of Bisintercalation in Higher-order DNA at a Junction-like Quadruplex
J.MOL.BIOL., 323, 2002
1M69
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BU of 1m69 by Molmil
Atomic Resolution Structure of 5Br-9amino-DACA with d[CGTACG]2
Descriptor: 5'-D(*CP*GP*TP*AP*CP*G)-3', 5-BROMO-N[2-(DIMETHYLAMINO)ETHYL]-9-AMINOACRIDINE-4-CARBOXAMIDE, SPERMINE
Authors:Teixeira, S.C.M, Thorpe, J.H, Todd, A.K, Cardin, C.J.
Deposit date:2002-07-15
Release date:2003-08-19
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Heavy Going: the Atomic Resolution Structure of a Topoisomerase II Poison Intercalating into DNA in Multiple Orientations Also Reveals a Multiple Adenine-Thymine Hydrogen Bonding Pattern
To be Published
4AH0
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BU of 4ah0 by Molmil
CRYSTAL STRUCTURE OF THE DB 985-D(CGCAAATTTGCG)2 COMPLEX AT 1.20 A RESOLUTION
Descriptor: 2-(4'-CARBAMIMIDOYL-2'-HYDROXYBIPHENYL-4-YL)-1H-BENZIMIDAZOLE-5-CARBOXIMIDAMIDE, 5'-D(*CP*GP*CP*AP*AP*AP*TP*TP*TP*GP*CP*GP)-3', MAGNESIUM ION
Authors:Munnur, D.G, Mitchell, E.P, Forsyth, V.T, Teixeira, S.C.M, Neidle, S.
Deposit date:2012-02-02
Release date:2013-01-16
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:A Detailed Study of Water Network in the Minor Groove of D(Cgcgaattcgcg)2 and D(Cgcaaatttgcg)2 in Presence of Linear Groove Binders
To be Published
4AH1
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BU of 4ah1 by Molmil
CRYSTAL STRUCTURE OF THE DB 921-D(CGCAAATTTGCG)2 COMPLEX AT 1.42 A RESOLUTION
Descriptor: 2-(4'-AMIDINOBIPHENYL-4-YL)-1H-BENZIMIDAZOLE-5-AMIDINE, 5'-D(*CP*GP*CP*AP*AP*AP*TP*TP*TP*GP*CP*GP)-3', MAGNESIUM ION
Authors:Munnur, D.G, Mitchell, E.P, Forsyth, V.T, Teixeira, S.C.M, Neidle, S.
Deposit date:2012-02-02
Release date:2013-01-16
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.42 Å)
Cite:A Detailed Study of Water Network in the Minor Groove of D(Cgcgaattcgcg)2 and D(Cgcaaatttgcg)2 in Presence of Linear Groove Binders
To be Published
4AGZ
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BU of 4agz by Molmil
CRYSTAL STRUCTURE OF THE DB 985-D(CGCGAATTCGCG)2 COMPLEX AT 1.25 A RESOLUTION.
Descriptor: 2-(4'-CARBAMIMIDOYL-2'-HYDROXYBIPHENYL-4-YL)-1H-BENZIMIDAZOLE-5-CARBOXIMIDAMIDE, 5'-D(*CP*GP*CP*GP*AP*AP*TP*TP*CP*GP*CP*GP)-3', MAGNESIUM ION
Authors:Munnur, D.G, Mitchell, E.P, Forsyth, V.T, Teixeira, S.C.M, Neidle, S.
Deposit date:2012-02-02
Release date:2013-01-16
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:A Detailed Study of Water Network in the Minor Groove of D(Cgcgaattcgcg)2 and D(Cgcaaatttgcg)2 in Presence of Linear Groove Binders
To be Published
1K6A
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BU of 1k6a by Molmil
Structural studies on the mobility in the active site of the Thermoascus aurantiacus xylanase I
Descriptor: xylanase I
Authors:Lo Leggio, L, Kalogiannis, S, Eckert, K, Teixeira, S.C.M, Bhat, M.K, Andrei, C, Pickersgill, R.W, Larsen, S.
Deposit date:2001-10-15
Release date:2002-07-03
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.14 Å)
Cite:Substrate specificity and subsite mobility in T. aurantiacus xylanase 10A.
FEBS LETT., 509, 2001
1L4J
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BU of 1l4j by Molmil
Holliday Junction TCGGTACCGA with Na and Ca Binding Sites.
Descriptor: 5'-D(*TP*CP*GP*GP*TP*AP*CP*CP*GP*A)-3', CALCIUM ION, SODIUM ION
Authors:Thorpe, J.H, Gale, B.C, Teixeira, S.C.M, Cardin, C.J.
Deposit date:2002-03-05
Release date:2003-03-04
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Conformational and Hydration Effects of Site-selective Sodium, Calcium and Strontium Ion Binding to the DNA Holliday Junction Structure d(TCGGTACCGA)4
J.Mol.Biol., 327, 2003
1MF5
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BU of 1mf5 by Molmil
GCATGCT Quadruplex
Descriptor: 5'-D(*GP*CP*AP*TP*GP*CP*T)-3', COBALT HEXAMMINE(III)
Authors:Thorpe, J.H, Teixeira, S.C.M, Gale, B.C, Cardin, C.J.
Deposit date:2002-08-09
Release date:2003-02-11
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Crystal structure of the complementary quadruplex formed by d(GCATGCT) at atomic resolution
Nucleic Acids Res., 31, 2003
1M6G
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BU of 1m6g by Molmil
Structural Characterisation of the Holliday Junction TCGGTACCGA
Descriptor: 5'-D(*TP*CP*GP*GP*TP*AP*CP*CP*GP*A)-3', STRONTIUM ION
Authors:Thorpe, J.H, Gale, B.C, Teixeira, S.C.M, Cardin, C.J.
Deposit date:2002-07-16
Release date:2003-05-06
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.652 Å)
Cite:Conformational and hydration effects of site-selective sodium, calcium and strontium ion binding to the DNA Holliday junction structure d(TCGGTACCGA)(4)
J.Mol.Biol., 327, 2003
1NVY
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BU of 1nvy by Molmil
Strontium bound to the Holliday junction sequence d(TCGGTACCGA)4
Descriptor: STRONTIUM ION, d(TCGGTACCGA)4
Authors:Cardin, C.J, Thorpe, J.H, Gale, B.C, Teixeira, S.C.M.
Deposit date:2003-02-05
Release date:2003-02-25
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Strontium, a MAD taerget for the DNA Holliday junction
To be published
1NVN
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BU of 1nvn by Molmil
Structural Characterisation of the Holliday junction formed by the sequence CCGGTACCGG at 1.8 A
Descriptor: 5'-D(CpCpGpGpTpApCpCpGpG)-3', CALCIUM ION
Authors:Cardin, C.J, Gale, B.C, Thorpe, J.H, Teixeira, S.C.M, Gan, Y, Moraes, M.I.A.A, Brogden, A.L.
Deposit date:2003-02-04
Release date:2003-02-25
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural analysis of two Holliday junctions formed by the sequences TCGGTACCGA and CCGGTACCGG
To be Published
1QYK
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BU of 1qyk by Molmil
GCATGCT + Barium
Descriptor: 5'-D(*GP*CP*AP*TP*GP*CP*T)-3', BARIUM ION
Authors:Cardin, C.J, Gan, Y, Thorpe, J.H, Teixeira, S.C.M, Gale, B.C, Moraes, M.I.A.
Deposit date:2003-09-11
Release date:2003-10-21
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Metal Ion Distribution and Stabilization of the DNA Quadruplex Structure Formed by d(GCATGCT)
To be published
1QZL
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BU of 1qzl by Molmil
GCATGCT + Cobalt
Descriptor: 5'-D(*GP*CP*AP*TP*GP*CP*T)-3', COBALT (II) ION
Authors:Cardin, C.J, Gan, Y, Thorpe, J.H, Teixeira, S.C.M, Gale, B.C, Moraes, M.I.A.
Deposit date:2003-09-17
Release date:2003-10-21
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:Metal Ion Distribution and Stabilisation of the DNA Quadruplex Structure Formed by d(GCATGCT)
To be published
1QYL
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BU of 1qyl by Molmil
GCATGCT + Vanadium
Descriptor: 5'-D(*GP*CP*AP*TP*GP*CP*T)-3', VANADIUM ION
Authors:Cardin, C.J, Gan, Y, Thorpe, J.H, Teixeira, S.C.M, Gale, B.C, Moraes, M.I.A.
Deposit date:2003-09-11
Release date:2003-10-21
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1 Å)
Cite:Metal Ion Distribution and Stabilisation of the DNA Quadruplex Structure Formed by d(GCATGCT)
To be Published
1R2O
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BU of 1r2o by Molmil
d(GCATGCT) + Ni2+
Descriptor: 5'-D(*GP*CP*AP*TP*GP*CP*T)-3', NICKEL (II) ION
Authors:Cardin, J.C, Gan, Y, Thorpe, J.H, Teixeira, S.C.M, Gale, B.C, Moraes, M.I.A.
Deposit date:2003-09-29
Release date:2003-10-21
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.38 Å)
Cite:Metal Ion Distribution and Stabilization of the DNA Quadruplex Structure Formed by d(GCATGCT)
To be published
5AMV
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BU of 5amv by Molmil
Structural insights into the loss of catalytic competence in pectate lyase at low pH
Descriptor: ACETATE ION, CALCIUM ION, GLYCEROL, ...
Authors:Teixeira, S.C.M, Ali, S, Sondergaard, C, Pickersgill, R.
Deposit date:2015-09-02
Release date:2015-09-30
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.57 Å)
Cite:Structural Insights Into the Loss of Catalytic Competence in Pectate Lyase Activity at Low Ph.
FEBS Lett., 589, 2015
3T86
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BU of 3t86 by Molmil
d(GCATGCT) + calcium
Descriptor: CALCIUM ION, DNA (5'-D(*GP*CP*AP*TP*GP*CP*T)-3'), POTASSIUM ION
Authors:Cardin, C.J, Gan, Y.
Deposit date:2011-08-01
Release date:2012-06-13
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:A novel structure for the d(GCATGCT) quadruplex in the presence of nickel and cobalt aqueous cations : comparison with the vanadium, barium and calcium-bound structural motif.
To be Published
1GOK
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BU of 1gok by Molmil
Thermostable xylanase I from Thermoascus aurantiacus- Crystal form II
Descriptor: ENDO-1,4-BETA-XYLANASE
Authors:Lo Leggio, L, Pickersgill, R.W.
Deposit date:2001-10-22
Release date:2001-10-25
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.14 Å)
Cite:Substrate Specificity and Subsite Mobility in T. Aurantiacus Xylanase 10A
FEBS Lett., 509, 2001
1GOQ
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BU of 1goq by Molmil
Thermostable xylanase I from Thermoascus aurantiacus - Room temperature xylobiose complex
Descriptor: ENDO-1,4-BETA-XYLANASE, beta-D-xylopyranose, beta-D-xylopyranose-(1-4)-beta-D-xylopyranose
Authors:Lo Leggio, L, Larsen, S.
Deposit date:2001-10-23
Release date:2001-12-07
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Substrate Specificity and Subsite Mobility in T. Aurantiacus Xylanase 10A
FEBS Lett., 509, 2001
1GOO
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BU of 1goo by Molmil
Thermostable xylanase I from Thermoascus aurantiacus - Cryocooled glycerol complex
Descriptor: ENDO-1,4-BETA-XYLANASE, GLYCEROL
Authors:Eckert, K, Andrei, C, Larsen, S, Lo Leggio, L.
Deposit date:2001-10-22
Release date:2001-12-03
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.87 Å)
Cite:Substrate Specificity and Subsite Mobility in T. Aurantiacus Xylanase 10A
FEBS Lett., 509, 2001
1GOM
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BU of 1gom by Molmil
Thermostable xylanase I from Thermoascus aurantiacus- Crystal form I
Descriptor: ENDO-1,4-BETA-XYLANASE
Authors:Lo Leggio, L, Pickersgill, R.W.
Deposit date:2001-10-22
Release date:2001-11-15
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.92 Å)
Cite:Substrate Specificity and Subsite Mobility in T. Aurantiacus Xylanase 10A
FEBS Lett., 509, 2001
4CVJ
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BU of 4cvj by Molmil
Neutron Structure of Compound I intermediate of Cytochrome c Peroxidase - Deuterium exchanged 100 K
Descriptor: CYTOCHROME C PEROXIDASE, MITOCHONDRIAL, PROTOPORPHYRIN IX CONTAINING FE
Authors:Casadei, C.M, Gumiero, A, Blakeley, M.P, Ostermann, A, Raven, E.L, Moody, P.C.E.
Deposit date:2014-03-27
Release date:2014-07-16
Last modified:2018-11-14
Method:NEUTRON DIFFRACTION (2.182 Å), X-RAY DIFFRACTION
Cite:Neutron Cryo-Crystallography Captures the Protonation State of Ferryl Heme in a Peroxidase
Science, 345, 2014
4CVI
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BU of 4cvi by Molmil
Neutron Structure of Ferric Cytochrome c Peroxidase - Deuterium exchanged at room temperature
Descriptor: CYTOCHROME C PEROXIDASE, MITOCHONDRIAL, PROTOPORPHYRIN IX CONTAINING FE
Authors:Casadei, C.M, Gumiero, A, Blakeley, M.P, Ostermann, A, Raven, E.L, Moody, P.C.E.
Deposit date:2014-03-27
Release date:2014-07-16
Last modified:2018-06-06
Method:NEUTRON DIFFRACTION (2.1 Å), X-RAY DIFFRACTION
Cite:Neutron Cryo-Crystallography Captures the Protonation State of Ferryl Heme in a Peroxidase
Science, 345, 2014
1GOR
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BU of 1gor by Molmil
THERMOSTABLE XYLANASE I FROM THERMOASCUS AURANTIACUS - XYLOBIOSE COMPLEX AT 100 K
Descriptor: ENDO-1,4-BETA-XYLANASE, beta-D-xylopyranose-(1-4)-alpha-D-xylopyranose
Authors:Lo Leggio, L, Larsen, S.
Deposit date:2001-10-23
Release date:2001-12-07
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Substrate Specificity and Subsite Mobility in T. Aurantiacus Xylanase 10A
FEBS Lett., 509, 2001
1JUC
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BU of 1juc by Molmil
Crystal Structure Analysis of a Holliday Junction Formed by CCGGTACCGG
Descriptor: 5'-D(*CP*CP*GP*GP*TP*AP*CP*CP*GP*G)-3'
Authors:Thorpe, J.H, Teixeira, S.C.M, Gale, B.C, Cardin, C.J.
Deposit date:2001-08-24
Release date:2002-02-22
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Structural characterization of a new crystal form of the four-way Holliday junction formed by the DNA sequence d(CCGGTACCGG)2: sequence versus lattice?
Acta Crystallogr.,Sect.D, 58, 2002

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