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2QSK
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BU of 2qsk by Molmil
Atomic-resolution crystal structure of the Recombinant form of Scytovirin
Descriptor: CHLORIDE ION, GLYCEROL, scytovirin
Authors:Moulaei, T, Botos, I, Ziolkowska, N.E, Dauter, Z, Wlodawer, A.
Deposit date:2007-07-31
Release date:2007-11-27
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1 Å)
Cite:Atomic-resolution crystal structure of the antiviral lectin scytovirin.
Protein Sci., 16, 2007
1Z5T
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BU of 1z5t by Molmil
Crystal Structure of [d(CGCGAA(Z3dU)(Z3dU)CGCG)]2, Z3dU:5-(3-aminopropyl)-2'-deoxyuridine, in presence of thallium I.
Descriptor: 5'-D(*CP*GP*CP*GP*AP*AP*(ZDU)P*(ZDU)P*CP*GP*CP*G)-3', SPERMINE, THALLIUM (I) ION
Authors:Moulaei, T, Maehigashi, T, Lountos, G.T, Komeda, S, Watkins, D, Stone, M.P, Marky, L.A, Li, J.S, Gold, B, Williams, L.D.
Deposit date:2005-03-19
Release date:2005-07-26
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Structure of B-DNA with cations tethered in the major groove.
Biochemistry, 44, 2005
2QT4
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BU of 2qt4 by Molmil
Atomic-resolution crystal structure of the natural form of Scytovirin
Descriptor: scytovirin
Authors:Moulaei, T, Botos, I, Ziolkowska, N.E, Dauter, Z, Wlodawer, A.
Deposit date:2007-08-01
Release date:2007-11-27
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Atomic-resolution crystal structure of the antiviral lectin scytovirin.
Protein Sci., 16, 2007
3LKY
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BU of 3lky by Molmil
Monomeric Griffithsin with a Single Gly-Ser Insertion
Descriptor: 1,2-ETHANEDIOL, GLYCEROL, Griffithsin, ...
Authors:Moulaei, T, Wlodawer, A.
Deposit date:2010-01-28
Release date:2010-10-06
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.11 Å)
Cite:Monomerization of viral entry inhibitor griffithsin elucidates the relationship between multivalent binding to carbohydrates and anti-HIV activity.
Structure, 18, 2010
3LL0
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BU of 3ll0 by Molmil
Monomeric Griffithsin with two Gly-Ser Insertions
Descriptor: GLYCEROL, Griffithsin, SULFATE ION
Authors:Moulaei, T, Wlodawer, A.
Deposit date:2010-01-28
Release date:2010-10-06
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Monomerization of viral entry inhibitor griffithsin elucidates the relationship between multivalent binding to carbohydrates and anti-HIV activity.
Structure, 18, 2010
3LL2
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BU of 3ll2 by Molmil
Monomeric Griffithsin in Complex with a High-Mannose Branched Carbohydrate
Descriptor: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, Griffithsin, ...
Authors:Moulaei, T, Wlodawer, A.
Deposit date:2010-01-28
Release date:2010-10-06
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (0.97 Å)
Cite:Monomerization of viral entry inhibitor griffithsin elucidates the relationship between multivalent binding to carbohydrates and anti-HIV activity.
Structure, 18, 2010
3LL1
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BU of 3ll1 by Molmil
Monomeric Griffithsin with a Single Gly-Ser Insertion and Mutations to Remove Residual Self-Association
Descriptor: CHLORIDE ION, Griffithsin
Authors:Moulaei, T, Wlodawer, A.
Deposit date:2010-01-28
Release date:2010-10-06
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (0.97 Å)
Cite:Monomerization of viral entry inhibitor griffithsin elucidates the relationship between multivalent binding to carbohydrates and anti-HIV activity.
Structure, 18, 2010
5MLX
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BU of 5mlx by Molmil
Open loop conformation of PhaZ7 Y105E mutant
Descriptor: CHLORIDE ION, PHB depolymerase PhaZ7, SODIUM ION
Authors:Kellici, T, Mavromoustakos, T, Jendrossek, D, Papageorgiou, A.C.
Deposit date:2016-12-08
Release date:2017-05-10
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Crystal structure analysis, covalent docking, and molecular dynamics calculations reveal a conformational switch in PhaZ7 PHB depolymerase.
Proteins, 85, 2017
3GGI
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BU of 3ggi by Molmil
Locating monovalent cations in one turn of G/C rich B-DNA
Descriptor: 5'-D(*CP*CP*AP*GP*GP*CP*CP*TP*GP*G) -3', MAGNESIUM ION, THALLIUM (I) ION
Authors:Maehigashi, T, Moulaei, T, Watkins, D, Komeda, S, Williams, L.D.
Deposit date:2009-02-28
Release date:2010-03-09
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (0.98 Å)
Cite:Locating monovalent cations in one turn of G/C rich B-DNA
To be Published
3GGK
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BU of 3ggk by Molmil
Locating monovalent cations in one turn of G/C rich B-DNA
Descriptor: 5'-D(*CP*CP*AP*GP*GP*CP*CP*TP*GP*G) -3', MAGNESIUM ION, RUBIDIUM ION
Authors:Maehigashi, T, Moulaei, T, Watkins, D, Komeda, S, Williams, L.D.
Deposit date:2009-02-28
Release date:2010-03-09
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (0.87 Å)
Cite:Locating monovalent cations in one turn of G/C rich B-DNA
To be Published
5MLY
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BU of 5mly by Molmil
Closed loop conformation of PhaZ7 Y105E mutant
Descriptor: PHB depolymerase PhaZ7
Authors:Kellici, T, Mavromoustakos, T, Jendrossek, D, Papageorgiou, A.C.
Deposit date:2016-12-08
Release date:2017-05-10
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (1.598 Å)
Cite:Crystal structure analysis, covalent docking, and molecular dynamics calculations reveal a conformational switch in PhaZ7 PHB depolymerase.
Proteins, 85, 2017
5EG9
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BU of 5eg9 by Molmil
The cap binding site of influenza virus protein PB2 as a drug target
Descriptor: Polymerase basic protein 2
Authors:Severin, C, Rocha de Moura, T, Liu, Y, Li, K, Zheng, X, Luo, M.
Deposit date:2015-10-26
Release date:2016-02-10
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:The cap-binding site of influenza virus protein PB2 as a drug target.
Acta Crystallogr D Struct Biol, 72, 2016
4ZB4
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BU of 4zb4 by Molmil
Spliceosome component
Descriptor: Pre-mRNA-processing factor 19
Authors:Rocha de Moura, T, Pena, P.
Deposit date:2015-04-14
Release date:2016-09-14
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Spliceosome component
To Be Published
5EG7
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BU of 5eg7 by Molmil
The cap binding site of influenza virus protein PB2 as a drug target
Descriptor: 7N-METHYL-8-HYDROGUANOSINE-5'-TRIPHOSPHATE, GLYCEROL, Polymerase basic protein 2
Authors:Severin, C, Rocha de Moura, T, Liu, Y, Li, K, Zheng, X, Luo, M.
Deposit date:2015-10-26
Release date:2016-02-10
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:The cap-binding site of influenza virus protein PB2 as a drug target.
Acta Crystallogr D Struct Biol, 72, 2016
5EG8
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BU of 5eg8 by Molmil
The cap binding site of influenza virus protein PB2 as a drug target
Descriptor: Polymerase basic protein 2, THIOCYANATE ION
Authors:Liu, Y, Zheng, X, Severin, C, Rocha de Moura, T, Li, K, Luo, M.
Deposit date:2015-10-26
Release date:2016-02-10
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.54 Å)
Cite:The cap-binding site of influenza virus protein PB2 as a drug target.
Acta Crystallogr D Struct Biol, 72, 2016
3HIH
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BU of 3hih by Molmil
Structure of human Plk1-PBD with glycerol and sulfate in the phophopeptide binding site
Descriptor: 1,2-ETHANEDIOL, GLYCEROL, SULFATE ION, ...
Authors:Wlodawer, A, Moulaei, T.
Deposit date:2009-05-20
Release date:2009-06-09
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural and functional analyses of minimal phosphopeptides targeting the polo-box domain of polo-like kinase 1.
Nat.Struct.Mol.Biol., 16, 2009
3HIK
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BU of 3hik by Molmil
Structure of human Plk1-PBD in complex with PLHSpT
Descriptor: 1,2-ETHANEDIOL, GLYCEROL, Pentamer phosphopeptide, ...
Authors:Wlodawer, A, Moulaei, T.
Deposit date:2009-05-20
Release date:2009-06-09
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:Structural and functional analyses of minimal phosphopeptides targeting the polo-box domain of polo-like kinase 1.
Nat.Struct.Mol.Biol., 16, 2009
3U89
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BU of 3u89 by Molmil
Crystal structure of one turn of g/c rich b-dna revisited
Descriptor: 5'-D(*CP*CP*AP*GP*GP*CP*CP*TP*GP*G) -3', MAGNESIUM ION
Authors:Maehigashi, T, Woods, K.K, Moulaei, T, Komeda, S, Williams, L.D.
Deposit date:2011-10-16
Release date:2011-11-09
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (0.96 Å)
Cite:B-DNA structure is intrinsically polymorphic: even at the level of base pair positions.
Nucleic Acids Res., 40, 2012
2DYW
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BU of 2dyw by Molmil
A Backbone binding DNA complex
Descriptor: (6-AMINOHEXYLAMINE)(TRIAMMINE) PLATINUM(II) COMPLEX, 5'-D(*CP*GP*CP*GP*AP*AP*TP*TP*CP*GP*CP*G)-3', SODIUM ION, ...
Authors:Komeda, S, Moulaei, T, Woods, K.K, Chikuma, M, Farrell, N.P, Williams, L.D.
Deposit date:2006-09-18
Release date:2007-01-02
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.13 Å)
Cite:A Third Mode of DNA Binding: Phosphate Clamps by a Polynuclear Platinum Complex
J.Am.Chem.Soc., 128, 2006
6UES
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BU of 6ues by Molmil
Apo SAM-IV Riboswitch
Descriptor: RNA (119-MER)
Authors:Zhang, K, Li, S, Kappel, K, Pintilie, G, Su, Z, Mou, T, Schmid, M, Das, R, Chiu, W.
Deposit date:2019-09-23
Release date:2019-12-18
Last modified:2024-03-20
Method:ELECTRON MICROSCOPY (3.7 Å)
Cite:Cryo-EM structure of a 40 kDa SAM-IV riboswitch RNA at 3.7 angstrom resolution.
Nat Commun, 10, 2019
6UET
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BU of 6uet by Molmil
SAM-bound SAM-IV riboswitch
Descriptor: RNA (119-MER), S-ADENOSYLMETHIONINE
Authors:Zhang, K, Li, S, Kappel, K, Pintilie, G, Su, Z, Mou, T, Schmid, M, Das, R, Chiu, W.
Deposit date:2019-09-23
Release date:2019-12-18
Last modified:2024-03-20
Method:ELECTRON MICROSCOPY (4.1 Å)
Cite:Cryo-EM structure of a 40 kDa SAM-IV riboswitch RNA at 3.7 angstrom resolution.
Nat Commun, 10, 2019
7RKA
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BU of 7rka by Molmil
Crystal structure analysis of Colorado potato beetle glutathione-S transferase LdGSTu1
Descriptor: GLUTATHIONE, glutathione S-transferase u1
Authors:Moural, T.W, Zhu, F.
Deposit date:2021-07-22
Release date:2022-07-06
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural and Functional Characterization of One Unclassified Glutathione S-Transferase in Xenobiotic Adaptation of Leptinotarsa decemlineata.
Int J Mol Sci, 22, 2021
3U4X
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BU of 3u4x by Molmil
Crystal structure of a lectin from Camptosema pedicellatum seeds in complex with 5-bromo-4-chloro-3-indolyl-alpha-D-mannose
Descriptor: 5-bromo-4-chloro-1H-indol-3-yl alpha-D-mannopyranoside, CALCIUM ION, Camptosema pedicellatum lectin (CPL), ...
Authors:Rocha, B.A.M, Teixeira, C.S, Moura, T.R, Silva, H.C, Pereira-Junior, F.N, Nagano, C.S, Delatorre, P, Cavada, B.S.
Deposit date:2011-10-10
Release date:2012-09-12
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.16 Å)
Cite:Crystal structure of the lectin of Camptosema pedicellatum: implications of a conservative substitution at the hydrophobic subsite.
J.Biochem., 152, 2012
5Z9C
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BU of 5z9c by Molmil
Solution NMR structures of BRD4 first bromodomain with small compound MMQO
Descriptor: 8-methoxy-6-methylquinolin-4(1H)-one, Bromodomain-containing protein 4
Authors:Zeng, L, Zhou, M.-M.
Deposit date:2018-02-02
Release date:2018-02-14
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:A New Quinoline BRD4 Inhibitor Targets a Distinct Latent HIV-1 Reservoir for Reactivation from Other "Shock" Drugs.
J. Virol., 92, 2018
5KHT
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BU of 5kht by Molmil
Crystal structure of the N-terminal fragment of tropomyosin isoform Tpm1.1 at 1.5 A resolution
Descriptor: DI(HYDROXYETHYL)ETHER, Tropomyosin alpha-1 chain,General control protein GCN4
Authors:Kostyukova, A.S, Krieger, I, Yoon, Y.-H, Tolkatchev, D, Samatey, F.A.
Deposit date:2016-06-15
Release date:2017-06-21
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.4964 Å)
Cite:Structural destabilization of tropomyosin induced by the cardiomyopathy-linked mutation R21H.
Protein Sci., 27, 2018

 

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