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7ON5
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BU of 7on5 by Molmil
Crystal structure of the SARS-CoV-2 neutralizing nanobody Re5D06
Descriptor: 1,2-ETHANEDIOL, ETHANOL, Nanobody Re5D06
Authors:Aksu, M, Guttler, T, Gorlich, D.
Deposit date:2021-05-25
Release date:2021-08-11
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Neutralization of SARS-CoV-2 by highly potent, hyperthermostable, and mutation-tolerant nanobodies.
Embo J., 40, 2021
4USC
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BU of 4usc by Molmil
Crystal structure of peroxidase from palm tree Chamaerops excelsa
Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, ...
Authors:Bernardes, A, Santos, J.C, Textor, L.C, Cuadrado, N.H, Kostetsky, E.Y, Roig, M.G, Muniz, J.R.C, Shnyrov, V.L, Polikarpov, I.
Deposit date:2014-07-07
Release date:2015-05-27
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Crystal Structure Analysis of Peroxidase from the Palm Tree Chamaerops Excelsa.
Biochimie, 111, 2015
3N4O
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BU of 3n4o by Molmil
Insights into the stabilizing contributions of a bicyclic cytosine analogue: crystal structures of DNA duplexes containing 7,8-dihydropyrido[2,3-d]pyrimidin-2-one
Descriptor: 2'-(4-HYDROXYPHENYL)-5-(4-METHYL-1-PIPERAZINYL)-2,5'-BI-BENZIMIDAZOLE, 5'-D(*CP*GP*CP*GP*AP*AP*TP*(B7C)P*CP*GP*CP*G)-3'
Authors:Takenaka, A, Juan, E.C.M, Shimizu, S.
Deposit date:2010-05-22
Release date:2010-08-11
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Insights into the DNA stabilizing contributions of a bicyclic cytosine analogue: crystal structures of DNA duplexes containing 7,8-dihydropyrido [2,3-d]pyrimidin-2-one.
Nucleic Acids Res., 2010
4UFB
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BU of 4ufb by Molmil
Crystal structure of the Angiotensin-1 converting enzyme N-domain in complex with Lys-Pro
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ANGIOTENSIN-CONVERTING ENZYME, CHLORIDE ION, ...
Authors:Masuyer, G, Douglas, R.G, Sturrock, E.D, Acharya, K.R.
Deposit date:2015-03-16
Release date:2015-10-07
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural Basis of Ac-Sdkp Hydrolysis by Angiotensin-I Converting Enzyme
Sci.Rep., 5, 2015
4UFA
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BU of 4ufa by Molmil
Crystal structure of the Angiotensin-1 converting enzyme N-domain in complex with Ac-SD
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ANGIOTENSIN-CONVERTING ENZYME, ...
Authors:Masuyer, G, Douglas, R.G, Sturrock, E.D, Acharya, K.R.
Deposit date:2015-03-16
Release date:2015-10-07
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural Basis of Ac-Sdkp Hydrolysis by Angiotensin-I Converting Enzyme
Sci.Rep., 5, 2015
4V3U
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BU of 4v3u by Molmil
Structure of human nNOS R354A G357D mutant heme domain in complex with N-2-(2-(1H-imidazol-1-yl)pyrimidin-4-yl)ethyl-3-(pyridin-3-yl) propan-1-amine
Descriptor: 5,6,7,8-TETRAHYDROBIOPTERIN, GLYCEROL, N-{2-[2-(1H-imidazol-1-yl)pyrimidin-4-yl]ethyl}-3-(pyridin-3-yl)propan-1-amine, ...
Authors:Li, H, Poulos, T.L.
Deposit date:2014-10-20
Release date:2014-12-24
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Novel 2,4-Disubstituted Pyrimidines as Potent, Selective, and Cell-Permeable Inhibitors of Neuronal Nitric Oxide Synthase.
J.Med.Chem., 58, 2015
8WNW
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BU of 8wnw by Molmil
the structure of PsaQ
Descriptor: 1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDE, CHLOROPHYLL A, PsaQ
Authors:Zhang, S.M, Si, L, Li, M.
Deposit date:2023-10-06
Release date:2024-05-29
Method:ELECTRON MICROSCOPY (3.5 Å)
Cite:Growth phase-dependent reorganization of cryptophyte photosystem I antennae.
Commun Biol, 7, 2024
9XZT
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BU of 9xzt by Molmil
Crystal structure of BBn6
Descriptor: 1-(2-METHOXY-ETHOXY)-2-{2-[2-(2-METHOXY-ETHOXY]-ETHOXY}-ETHANE, BBn6, SULFATE ION, ...
Authors:Bera, A.K, Kim, D, Baker, D.
Deposit date:2025-08-27
Release date:2025-09-03
Last modified:2025-10-01
Method:X-RAY DIFFRACTION (2.03 Å)
Cite:Parametrically guided design of beta barrels and transmembrane nanopores using deep learning.
Proc.Natl.Acad.Sci.USA, 122, 2025
9UDY
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BU of 9udy by Molmil
Crystal structure of recombinant mushroom Agaricus bisporus mannose-binding protein with a longer C-terminal region
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Lectin-like fold protein
Authors:Yoshida, H, Ismaya, W.T.
Deposit date:2025-04-07
Release date:2025-05-21
Last modified:2025-06-11
Method:X-RAY DIFFRACTION (1.51 Å)
Cite:Crystal structure of a recombinant Agaricus bisporus mushroom mannose-binding protein with a longer C-terminal region.
Acta Crystallogr.,Sect.F, 81, 2025
4UO3
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BU of 4uo3 by Molmil
Structure of the A_Equine_Richmond_07 H3 haemagglutinin mutant Ser30Thr
Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Vachieri, S.G, Collins, P.J, Haire, L.F, Ogrodowicz, R.W, Martin, S.R, Walker, P.A, Xiong, X, Gamblin, S.J, Skehel, J.J.
Deposit date:2014-05-31
Release date:2014-07-23
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.87 Å)
Cite:Recent Evolution of Equine Influenza and the Origin of Canine Influenza.
Proc.Natl.Acad.Sci.USA, 111, 2014
8F1S
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BU of 8f1s by Molmil
A benzimidazole (DB1476) sequence-specific recognition of 5'-CGCAAAAAAGCG-3' in A-orientation
Descriptor: 4,4'-(1H-benzimidazole-2,6-diyl)di(benzene-1-carboximidamide), DNA (5'-D(*CP*GP*CP*AP*AP*AP*AP*AP*AP*GP*CP*G)-3'), DNA (5'-D(*CP*GP*CP*TP*TP*TP*TP*TP*TP*GP*CP*G)-3'), ...
Authors:Ogbonna, E.N, Wilson, W.D.
Deposit date:2022-11-06
Release date:2023-02-22
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:X-ray Structure Characterization of the Selective Recognition of AT Base Pair Sequences.
Acs Bio Med Chem Au, 3, 2023
8F1V
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BU of 8f1v by Molmil
A benzimidazole (DB1476) sequence-specific recognition of 5'-CGCAAAAAAGCG-3' in B-orientation
Descriptor: 4,4'-(1H-benzimidazole-2,6-diyl)di(benzene-1-carboximidamide), DNA (5'-D(*CP*GP*CP*AP*AP*AP*AP*AP*AP*GP*CP*G)-3'), DNA (5'-D(*CP*GP*CP*TP*TP*TP*TP*TP*TP*GP*CP*G)-3'), ...
Authors:Ogbonna, E.N, Wilson, W.D.
Deposit date:2022-11-06
Release date:2023-02-22
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.1 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
447D
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BU of 447d by Molmil
5'-D(*CP*GP*CP*GP*AP*AP*TP*TP*CP*GP*CP*G)-3'
Descriptor: 2'-(4-DIMETHYLAMINOPHENYL)-5-(4-METHYL-1-PIPERAZINYL)-2,5'-BI-BENZIMIDAZOLE, DNA (5'-D(*CP*GP*CP*GP*AP*AP*TP*TP*CP*GP*CP*G)-3')
Authors:Squire, C.J, Baker, L.J, Clark, G.R, Martin, R.F, White, J.
Deposit date:1999-01-18
Release date:2000-03-06
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structures of m-iodo Hoechst-DNA complexes in crystals with reduced solvent content: implications for minor groove binder drug design.
Nucleic Acids Res., 28, 2000
4W4O
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BU of 4w4o by Molmil
High-resolution crystal structure of Fc bound to its human receptor Fc-gamma-RI
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ACETATE ION, GLYCEROL, ...
Authors:Caaveiro, J.M.M, Kiyoshi, M, Tsumoto, K.
Deposit date:2014-08-15
Release date:2015-04-29
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural basis for binding of human IgG1 to its high-affinity human receptor Fc gamma RI
Nat Commun, 6, 2015
1G4Q
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BU of 1g4q by Molmil
RNA/DNA HYBRID DECAMER OF CAAAGAAAAG/CTTTTCTTTG
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 5'-D(*CP*TP*TP*TP*TP*CP*TP*TP*TP*G)-3', 5'-R(*CP*AP*AP*AP*GP*AP*AP*AP*AP*G)-3', ...
Authors:Han, G.W.
Deposit date:2000-10-27
Release date:2003-07-08
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.15 Å)
Cite:Direct-methods determination of an RNA/DNA hybrid decamer at 1.15 A resolution.
Acta Crystallogr.,Sect.D, 57, 2001
9PWN
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BU of 9pwn by Molmil
Crystal structure of Fabs 7411 in complex with TREM2 peptide
Descriptor: 1,2-ETHANEDIOL, 7411 Fab Heavy Chain, 7411 Fab Light Chain, ...
Authors:Arndt, J.W, Chao, Q, Cooke, H.A, Almeida, A.D.S.
Deposit date:2025-08-04
Release date:2025-09-10
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Building a potent TREM2 agonistic, biparatopic, common light chain antibody.
Mabs, 17, 2025
9U3N
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BU of 9u3n by Molmil
Crystal structure of FGFR2 kinase domain gatekeeper mutant V564F in complex with compound LC-F2-01
Descriptor: Fibroblast growth factor receptor 2, ~{N}-[4-[4-azanyl-7-methyl-5-[2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethynyl]pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]prop-2-enamide
Authors:Chen, L.
Deposit date:2025-03-18
Release date:2025-04-23
Method:X-RAY DIFFRACTION (3.25 Å)
Cite:Crystal structure of FGFR2 kinase domain gatekeeper mutant V564F in complex with compound LC-F2-1
To Be Published
9XY2
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BU of 9xy2 by Molmil
One of a series of engineered variants of I-OnuI meganuclease targeting altered DNA target sequence
Descriptor: 1,2-ETHANEDIOL, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, CALCIUM ION, ...
Authors:Werther, R, Schwensen, J.S, Stoddard, B.L.
Deposit date:2025-08-25
Release date:2025-09-10
Method:X-RAY DIFFRACTION (2.402 Å)
Cite:Prediction, modeling and design of protein-DNA recognition via computational and machine learning approaches: accomplishments and remaining challenges
To Be Published
9NZ3
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BU of 9nz3 by Molmil
SARS-CoV M protein dimer in complex with JNJ-9676 and FAb B
Descriptor: (6S,8R)-N-(3-cyanophenyl)-5-{4-[difluoro(phenyl)methyl]phenyl}-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide, FAb B heavy chain, FAb B light chain, ...
Authors:Mann, M.K, Abeywickrema, P.
Deposit date:2025-03-31
Release date:2025-10-29
Method:ELECTRON MICROSCOPY (3.07 Å)
Cite:SARS-CoV M protein dimer in complex with JNJ-9676 and FAb B
To Be Published
9XYA
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BU of 9xya by Molmil
One of a series of engineered variants of I-OnuI meganuclease targeting altered DNA target sequence
Descriptor: 1,2-ETHANEDIOL, CALCIUM ION, DNA (26-MER), ...
Authors:Werther, R, Stoddard, B.L.
Deposit date:2025-08-25
Release date:2025-09-10
Method:X-RAY DIFFRACTION (2.303 Å)
Cite:Prediction, modeling and design of protein-DNA recognition via computational and machine learning approaches: accomplishments and remaining challenges
To Be Published
6W47
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BU of 6w47 by Molmil
Peptoid-Containing Collagen Peptide
Descriptor: 1,2-ETHANEDIOL, Collagen-like peptide
Authors:Chenoweth, D.M, Melton, S.D.
Deposit date:2020-03-10
Release date:2020-08-12
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.15 Å)
Cite:Rules for the design of aza-glycine stabilized triple-helical collagen peptides.
Chem Sci, 11, 2020
6VZC
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BU of 6vzc by Molmil
Tandem UU:GA mismatch within an RNA helix
Descriptor: RNA 28-mer
Authors:Nikonowicz, E.P, Chang, A.T.
Deposit date:2020-02-28
Release date:2020-09-02
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:2-Amino-1,3-benzothiazole-6-carboxamide Preferentially Binds the Tandem Mismatch Motif r(UY:GA).
Biochemistry, 59, 2020
8UYP
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BU of 8uyp by Molmil
SARS-CoV-1 5' proximal stem-loop 5
Descriptor: SARS-CoV-1 5' proximal stem-loop 5
Authors:Kretsch, R.C, Xu, L, Zheludev, I.N, Zhou, X, Huang, R, Nye, G, Li, S, Zhang, K, Chiu, W, Das, R.
Deposit date:2023-11-13
Release date:2023-12-20
Last modified:2024-03-13
Method:ELECTRON MICROSCOPY (7.1 Å)
Cite:Tertiary folds of the SL5 RNA from the 5' proximal region of SARS-CoV-2 and related coronaviruses.
Proc.Natl.Acad.Sci.USA, 121, 2024
9LE3
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BU of 9le3 by Molmil
Consensus map of UCC118 Rool RNA
Descriptor: UCC118 Rool RNA
Authors:Zhang, K, Li, S.
Deposit date:2025-01-07
Release date:2025-09-10
Last modified:2025-10-29
Method:ELECTRON MICROSCOPY (2.75 Å)
Cite:Structural insights into higher-order natural RNA-only multimers.
Nat.Struct.Mol.Biol., 32, 2025

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PDB entries from 2025-11-05

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