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8Y64
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BU of 8y64 by Molmil
Crystal structure of open state ferulic acid decarboxylase from Saccharomyces cerevisiae, F397V/I398L/T438P/P441V mutant
Descriptor: DI(HYDROXYETHYL)ETHER, Ferulic acid decarboxylase 1, GLYCEROL
Authors:Feng, Y.B, Song, X, Zhu, X.N.
Deposit date:2024-02-01
Release date:2025-01-01
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Integrated strategies for engineering ferulic acid decarboxylase with tunnel conformation and substrate pocket for adapting non-natural substrates.
Biochem Eng J, 213, 2025
5IC1
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BU of 5ic1 by Molmil
Structural analysis of a talin triple domain module, E1794Y, E1797Y, Q1801Y mutant
Descriptor: 1,2-ETHANEDIOL, Talin-1
Authors:Wu, J, Chang, Y.-C.E, Zhang, H, Huang, Q.-Q.
Deposit date:2016-02-22
Release date:2016-05-18
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural and Functional Analysis of a Talin Triple-Domain Module Suggests an Alternative Talin Autoinhibitory Configuration.
Structure, 24, 2016
3GH9
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BU of 3gh9 by Molmil
Crystal structure of EDTA-treated BdbD (Oxidised)
Descriptor: 1,2-ETHANEDIOL, Disulfide bond formation protein D, UNKNOWN ATOM OR ION
Authors:Crow, A, Lewin, A, Hederstedt, L, Le-Brun, N.E.
Deposit date:2009-03-03
Release date:2009-06-16
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (1.69 Å)
Cite:Crystal Structure and Biophysical Properties of Bacillus subtilis BdbD: AN OXIDIZING THIOL:DISULFIDE OXIDOREDUCTASE CONTAINING A NOVEL METAL SITE
J.Biol.Chem., 284, 2009
9OPB
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BU of 9opb by Molmil
Herpes simplex virus type 1 (HSV-1) D-capsid pUL6 portal protein turrets, decamer
Descriptor: Capsid portal protein
Authors:Crofut, E.H, Kashyap, S, Stevens, A, Jih, J, Liu, Y.-T, Zhou, Z.H.
Deposit date:2025-05-17
Release date:2025-05-28
Last modified:2025-07-30
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:Structure of a new capsid form and comparison with A-, B-, and C-capsids clarify herpesvirus assembly.
J.Virol., 99, 2025
9F63
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BU of 9f63 by Molmil
Crystal structure of Saccharomyces cerevisiae pH nine-sensitive protein 1 (PNS1)
Descriptor: Protein PNS1
Authors:Driller, J.H, Pedersen, B.P.
Deposit date:2024-04-30
Release date:2024-05-15
Method:X-RAY DIFFRACTION (2.73 Å)
Cite:S. cerevisiae pH nine-sensitive protein 1 is not a choline transporter.
To Be Published
6T3L
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BU of 6t3l by Molmil
PAS-GAF fragment from Deinococcus radiodurans phytochrome in dark state
Descriptor: 3-[2-[(Z)-[3-(2-carboxyethyl)-5-[(Z)-(4-ethenyl-3-methyl-5-oxidanylidene-pyrrol-2-ylidene)methyl]-4-methyl-pyrrol-1-ium -2-ylidene]methyl]-5-[(Z)-[(3E)-3-ethylidene-4-methyl-5-oxidanylidene-pyrrolidin-2-ylidene]methyl]-4-methyl-1H-pyrrol-3- yl]propanoic acid, Bacteriophytochrome
Authors:Claesson, E, Takala, H, Yuan Wahlgren, W, Pandey, S, Schmidt, M, Westenhoff, S.
Deposit date:2019-10-11
Release date:2020-04-08
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (2.07 Å)
Cite:The primary structural photoresponse of phytochrome proteins captured by a femtosecond X-ray laser.
Elife, 9, 2020
6T3U
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BU of 6t3u by Molmil
PAS-GAF fragment from Deinococcus radiodurans phytochrome 1ps after photoexcitation
Descriptor: 3-[2-[(Z)-[3-(2-carboxyethyl)-5-[(Z)-(4-ethenyl-3-methyl-5-oxidanylidene-pyrrol-2-ylidene)methyl]-4-methyl-pyrrol-1-ium -2-ylidene]methyl]-5-[(Z)-[(3E)-3-ethylidene-4-methyl-5-oxidanylidene-pyrrolidin-2-ylidene]methyl]-4-methyl-1H-pyrrol-3- yl]propanoic acid, Bacteriophytochrome
Authors:Claesson, E, Takala, H, Yuan Wahlgren, W, Pandey, S, Schmidt, M, Westenhoff, S.
Deposit date:2019-10-11
Release date:2020-04-08
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.21 Å)
Cite:The primary structural photoresponse of phytochrome proteins captured by a femtosecond X-ray laser.
Elife, 9, 2020
9OP5
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BU of 9op5 by Molmil
Herpes simplex virus type 1 (HSV-1) B-capsid pUL6 portal protein, dodecameric complex
Descriptor: Capsid portal protein, Capsid scaffolding protein
Authors:Crofut, E.H, Kashyap, S, Stevens, A, Jih, J, Liu, Y.-T, Zhou, Z.H.
Deposit date:2025-05-16
Release date:2025-05-28
Last modified:2025-07-30
Method:ELECTRON MICROSCOPY (3.5 Å)
Cite:Structure of a new capsid form and comparison with A-, B-, and C-capsids clarify herpesvirus assembly.
J.Virol., 99, 2025
9OPC
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BU of 9opc by Molmil
Herpes simplex virus type 1 (HSV-1) C-capsid pUL6 portal protein, dodecameric complex
Descriptor: Capsid portal protein
Authors:Crofut, E.H, Kashyap, S, Stevens, A, Jih, J, Liu, Y.-T, Zhou, Z.H.
Deposit date:2025-05-18
Release date:2025-05-28
Last modified:2025-08-06
Method:ELECTRON MICROSCOPY (4.2 Å)
Cite:Structure of a new capsid form and comparison with A-, B-, and C-capsids clarify herpesvirus assembly.
J.Virol., 99, 2025
5BSV
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BU of 5bsv by Molmil
Crystal structure of 4-coumarate:CoA ligase complexed with feruloyl adenylate
Descriptor: 4-coumarate--CoA ligase 2, 5'-O-[(R)-hydroxy{[(2E)-3-(5-methoxy-4-oxocyclohexa-1,5-dien-1-yl)prop-2-enoyl]oxy}phosphoryl]adenosine
Authors:Li, Z, Nair, S.K.
Deposit date:2015-06-02
Release date:2016-05-11
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural Basis for Specificity and Flexibility in a Plant 4-Coumarate:CoA Ligase.
Structure, 23, 2015
6IL9
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BU of 6il9 by Molmil
One Glycerol complexed Crystal structure of fructuronate-tagaturonate epimerase UxaE from Cohnella laeviribosi
Descriptor: Fructuronate-tagaturonate epimerase UxaE from Cohnella laeviribosi in complex with 1 glycerol, GLYCEROL, ZINC ION
Authors:Choi, M.Y, Kang, L.W, Ho, T.H, Nguyen, D.Q, Lee, I.H, Lee, J.H, Park, Y.S, Park, H.J.
Deposit date:2018-10-17
Release date:2019-10-23
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1.72005355 Å)
Cite:Crystal structure of fructuronate-tagaturonate epimerase UxaE from Cohnella laeviribosi
To Be Published
3GBE
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BU of 3gbe by Molmil
Crystal structure of the isomaltulose synthase SmuA from Protaminobacter rubrum in complex with the inhibitor deoxynojirimycin
Descriptor: 1,2-ETHANEDIOL, 1-DEOXYNOJIRIMYCIN, CITRATE ANION, ...
Authors:Ravaud, S, Robert, X, Haser, R, Aghajari, N.
Deposit date:2009-02-19
Release date:2009-05-26
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural determinants of product specificity of sucrose isomerases
Febs Lett., 583, 2009
9OP8
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BU of 9op8 by Molmil
Herpes simplex virus type 1 (HSV-1) D-capsid pUL6 portal protein, dodecameric complex
Descriptor: Capsid portal protein
Authors:Crofut, E.H, Kashyap, S, Stevens, A, Jih, J, Liu, Y.-T, Zhou, Z.H.
Deposit date:2025-05-17
Release date:2025-05-28
Last modified:2025-07-30
Method:ELECTRON MICROSCOPY (3.8 Å)
Cite:Structure of a new capsid form and comparison with A-, B-, and C-capsids clarify herpesvirus assembly.
J.Virol., 99, 2025
5BSY
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BU of 5bsy by Molmil
Crystal structure of GII.10 P domain in complex with lemon juice
Descriptor: 1,2-ETHANEDIOL, CITRATE ANION, Capsid protein, ...
Authors:Koromyslova, A.D, Hansman, G.S.
Deposit date:2015-06-02
Release date:2015-09-09
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Treatment of norovirus particles with citrate.
Virology, 485, 2015
6I5Z
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BU of 6i5z by Molmil
Papaver somniferum O-methyltransferase
Descriptor: O-methyltransferase 1, S-ADENOSYL-L-HOMOCYSTEINE, S-ADENOSYLMETHIONINE
Authors:Davies, G.J, Cabry, M.P, Offen, W.A.
Deposit date:2018-11-15
Release date:2019-03-27
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (3 Å)
Cite:Structure of Papaver somniferum O-Methyltransferase 1 Reveals Initiation of Noscapine Biosynthesis with Implications for Plant Natural Product Methylation
Acs Catalysis, 2019
7X42
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BU of 7x42 by Molmil
Cryo-EM structure of Coxsackievirus B1 pre-A-particle in complex with nAb 8A10 (classified from CVB1 mature virion in complex with 8A10 and 2E6)
Descriptor: 8A10 heavy chain, 8A10 light chain, Capsid protein VP0, ...
Authors:Zheng, Q, Zhu, R, Sun, H, Cheng, T, Li, S, Xia, N.
Deposit date:2022-03-01
Release date:2022-09-28
Last modified:2025-06-25
Method:ELECTRON MICROSCOPY (3.88 Å)
Cite:Structural basis for the synergistic neutralization of coxsackievirus B1 by a triple-antibody cocktail.
Cell Host Microbe, 30, 2022
5ESB
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BU of 5esb by Molmil
Crystal structure of a genotype 1a/3a chimeric HCV NS3/4A protease in complex with Vaniprevir
Descriptor: (5R,7S,10S)-10-tert-butyl-N-{(1R,2R)-1-[(cyclopropylsulfonyl)carbamoyl]-2-ethylcyclopropyl}-15,15-dimethyl-3,9,12-trioxo-6,7,9,10,11,12,14,15,16,17,18,19-dodecahydro-1H,5H-2,23:5,8-dimethano-4,13,2,8,11-benzodioxatriazacyclohenicosine-7(3H)-carboxamide, NS3 protease, SULFATE ION, ...
Authors:Soumana, D, Yilmaz, N.K, Ali, A, Prachanronarong, K.L, Schiffer, C.A.
Deposit date:2015-11-16
Release date:2016-11-30
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Molecular and Dynamic Mechanism Underlying Drug Resistance in Genotype 3 Hepatitis C NS3/4A Protease.
J.Am.Chem.Soc., 138, 2016
3EAM
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BU of 3eam by Molmil
An open-pore structure of a bacterial pentameric ligand-gated ion channel
Descriptor: 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, DODECYL-BETA-D-MALTOSIDE, Glr4197 protein
Authors:Bocquet, N, Nury, H, Baaden, M, Le Poupon, C, Changeux, J.P, Delarue, M, Corringer, P.J.
Deposit date:2008-08-26
Release date:2008-11-04
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:X-ray structure of a pentameric ligand-gated ion channel in an apparently open conformation.
Nature, 457, 2009
9OP4
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BU of 9op4 by Molmil
Herpes simplex virus type 1 (HSV-1) A-capsid pUL6 portal protein, dodecameric complex
Descriptor: Capsid portal protein, Capsid scaffolding protein
Authors:Crofut, E.H, Kashyap, S, Stevens, A, Jih, J, Liu, Y.-T, Zhou, Z.H.
Deposit date:2025-05-16
Release date:2025-06-11
Last modified:2025-07-30
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:Structure of a new capsid form and comparison with A-, B-, and C-capsids clarify herpesvirus assembly.
J.Virol., 99, 2025
5HWJ
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BU of 5hwj by Molmil
Crystal structure of keto-deoxy-D-galactarate dehydratase
Descriptor: FORMIC ACID, GLYCEROL, Probable 5-dehydro-4-deoxyglucarate dehydratase
Authors:Taberman, H, Parkkinen, T, Hakulinen, N, Rouvinen, J.
Deposit date:2016-01-29
Release date:2016-03-23
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.648 Å)
Cite:Structure and function of a decarboxylating Agrobacterium tumefaciens keto-deoxy-d-galactarate dehydratase.
Biochemistry, 53, 2014
4WBU
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BU of 4wbu by Molmil
prion peptide
Descriptor: PrP peptide
Authors:Yu, L, Lee, S.-J, Yee, V.
Deposit date:2014-09-03
Release date:2015-05-27
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.15 Å)
Cite:Crystal Structures of Polymorphic Prion Protein beta 1 Peptides Reveal Variable Steric Zipper Conformations.
Biochemistry, 54, 2015
7VRS
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BU of 7vrs by Molmil
The complex of Acyltransferase and Acyl Carrier Protein Domains from module 9 of Salinomycin Polyketide Synthase
Descriptor: 1,1'-butane-1,4-diylbis(1H-pyrrole-2,5-dione), 4'-PHOSPHOPANTETHEINE, Type I modular polyketide synthase
Authors:Feng, Y, Zheng, J.
Deposit date:2021-10-24
Release date:2022-06-08
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structural visualization of transient interactions between the cis-acting acyltransferase and acyl carrier protein of the salinomycin modular polyketide synthase.
Acta Crystallogr D Struct Biol, 78, 2022
7D5V
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BU of 7d5v by Molmil
Structure of the C646A mutant of peptidylarginine deiminase type III (PAD3)
Descriptor: 1,2-ETHANEDIOL, GLYCEROL, Protein-arginine deiminase type-3
Authors:Akimoto, M, Mashimo, R, Unno, M.
Deposit date:2020-09-28
Release date:2021-06-02
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.102 Å)
Cite:Structures of human peptidylarginine deiminase type III provide insights into substrate recognition and inhibitor design.
Arch.Biochem.Biophys., 708, 2021
5AP1
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BU of 5ap1 by Molmil
Naturally Occurring Mutations in the MPS1 Gene Predispose Cells to Kinase Inhibitor Drug Resistance.
Descriptor: 6-{[3-(cyanomethoxy)-4-(1-methyl-1H-pyrazol-4-yl)phenyl]amino}-2-(cyclohexylamino)pyridine-3-carbonitrile, DUAL SPECIFICITY PROTEIN KINASE TTK, GLYCEROL, ...
Authors:Gurden, M.D, Westwood, I.M, Faisal, A, Naud, S, Cheung, K.J, McAndrew, C, Wood, A, Schmitt, J, Boxall, K, Mak, G, Workman, P, Burke, R, Hoelder, S, Blagg, J, van Montfort, R.L.M, Linardopoulos, S.
Deposit date:2015-09-14
Release date:2015-09-23
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Naturally Occurring Mutations in the Mps1 Gene Predispose Cells to Kinase Inhibitor Drug Resistance.
Cancer Res., 75, 2015
9OPV
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BU of 9opv by Molmil
Herpes simplex virus type 1 (HSV-1) C-Capsid portal turrets
Descriptor: Capsid portal protein
Authors:Crofut, E.H, Kashyap, S, Stevens, A, Jih, J, Liu, Y.-T, Zhou, Z.H.
Deposit date:2025-05-20
Release date:2025-06-11
Last modified:2025-07-30
Method:ELECTRON MICROSCOPY (3.4 Å)
Cite:Structure of a new capsid form and comparison with A-, B-, and C-capsids clarify herpesvirus assembly.
J.Virol., 99, 2025

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