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8SPE
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BU of 8spe by Molmil
Crystal structure of Bax core domain BH3-groove dimer - tetrameric fraction P31
Descriptor: 1,2-ETHANEDIOL, Apoptosis regulator BAX, DI(HYDROXYETHYL)ETHER, ...
Authors:Miller, M.S, Cowan, A.D, Colman, P.M, Czabotar, P.E.
Deposit date:2023-05-03
Release date:2023-12-27
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Sequence differences between BAX and BAK core domains manifest as differences in their interactions with lipids.
Febs J., 291, 2024
8SPZ
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BU of 8spz by Molmil
Crystal structure of Bax core domain BH3-groove dimer - hexameric fraction with dioctanoyl phosphatidylserine
Descriptor: Apoptosis regulator BAX, SULFATE ION
Authors:Cowan, A.D, Colman, P.M, Czabotar, P.E, Miller, M.S.
Deposit date:2023-05-04
Release date:2023-12-27
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Sequence differences between BAX and BAK core domains manifest as differences in their interactions with lipids.
Febs J., 291, 2024
8SVK
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BU of 8svk by Molmil
Crystal structure of Bax D71N core domain BH3-groove dimer
Descriptor: Apoptosis regulator BAX, DI(HYDROXYETHYL)ETHER, SULFATE ION, ...
Authors:Miller, M.S, Czabotar, P.E, Colman, P.M.
Deposit date:2023-05-16
Release date:2023-12-27
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Sequence differences between BAX and BAK core domains manifest as differences in their interactions with lipids.
Febs J., 291, 2024
8SPF
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BU of 8spf by Molmil
Crystal structure of Bax core domain BH3-groove dimer - hexameric fraction with 2-stearoyl lysoPC
Descriptor: 1,2-ETHANEDIOL, Apoptosis regulator BAX, DODECANE, ...
Authors:Cowan, A.D, Miller, M.S, Czabotar, P.E, Colman, P.M.
Deposit date:2023-05-03
Release date:2023-12-27
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Sequence differences between BAX and BAK core domains manifest as differences in their interactions with lipids.
Febs J., 291, 2024
8SRX
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BU of 8srx by Molmil
Crystal structure of BAK-BAX heterodimer with lysoPC
Descriptor: 1,2-ETHANEDIOL, Apoptosis regulator BAX, Bcl-2 homologous antagonist/killer, ...
Authors:Brouwer, J.M, Czabotar, P.E, Colman, P.M, Miller, M.S.
Deposit date:2023-05-07
Release date:2023-12-27
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:Sequence differences between BAX and BAK core domains manifest as differences in their interactions with lipids.
Febs J., 291, 2024
8SRY
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BU of 8sry by Molmil
Crystal structure of BAK-BAX heterodimer with C12E8
Descriptor: 2-(2-METHOXYETHOXY)ETHANOL, 3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOL, 3,6,9,12,15-PENTAOXATRICOSAN-1-OL, ...
Authors:Brouwer, J.M, Czabotar, P.E, Colman, P.M, Miller, M.S.
Deposit date:2023-05-08
Release date:2023-12-27
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Sequence differences between BAX and BAK core domains manifest as differences in their interactions with lipids.
Febs J., 291, 2024
8SQF
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BU of 8sqf by Molmil
OXA-48 bound to inhibitor CDD-2725
Descriptor: (1M)-3'-(benzyloxy)-5-hydroxy[1,1'-biphenyl]-3,4'-dicarboxylic acid, BICARBONATE ION, Beta-lactamase
Authors:Park, S, Judge, A, Fan, J, Sankaran, B, Prasad, B.V.V, Palzkill, T.
Deposit date:2023-05-04
Release date:2024-01-03
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Exploiting the Carboxylate-Binding Pocket of beta-Lactamase Enzymes Using a Focused DNA-Encoded Chemical Library.
J.Med.Chem., 67, 2024
8SQG
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BU of 8sqg by Molmil
OXA-48 bound to inhibitor CDD-2801
Descriptor: (1M)-3'-(benzyloxy)-5-[2-(methylamino)-2-oxoethoxy][1,1'-biphenyl]-3,4'-dicarboxylic acid, BICARBONATE ION, Beta-lactamase
Authors:Park, S, Judge, A, Fan, J, Sankaran, B, Palzkill, T.
Deposit date:2023-05-04
Release date:2024-01-03
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.03 Å)
Cite:Exploiting the Carboxylate-Binding Pocket of beta-Lactamase Enzymes Using a Focused DNA-Encoded Chemical Library.
J.Med.Chem., 67, 2024
7YVR
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BU of 7yvr by Molmil
Crystal Structure of L-Threonine Aldolase from Neptunomonas marina
Descriptor: GLYCEROL, L-threonine aldolase
Authors:He, Y.Z, Wang, J, Yan, W.P, Zhang, Y, Feng, Y.
Deposit date:2022-08-19
Release date:2023-05-24
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Discovery and Engineering of the L-Threonine Aldolase from Neptunomonas marine for the Efficient Synthesis of beta-Hydroxy-alpha-amino Acids via C-C Formation
Acs Catalysis, 2023
9EO7
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BU of 9eo7 by Molmil
PHF type tau filament from V337M mutant
Descriptor: Isoform Tau-F of Microtubule-associated protein tau
Authors:Qi, C, Scheres, S.H.W, Michel, G.
Deposit date:2024-03-14
Release date:2024-07-10
Method:ELECTRON MICROSCOPY (2.8 Å)
Cite:Tau filaments with the Alzheimer fold in cases with MAPT mutations V337M and R406W.
Biorxiv, 2024
9EO9
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BU of 9eo9 by Molmil
SF type tau filament from V337M mutant
Descriptor: Isoform Tau-F of Microtubule-associated protein tau
Authors:Qi, C, Scheres, S.H.W, Michel, G.
Deposit date:2024-03-14
Release date:2024-07-10
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (3.3 Å)
Cite:Tau filaments with the Alzheimer fold in cases with MAPT mutations V337M and R406W.
Biorxiv, 2024
9EOE
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BU of 9eoe by Molmil
TF type tau filament from V337M mutant
Descriptor: Isoform Tau-F of Microtubule-associated protein tau
Authors:Qi, C, Scheres, S.H.W, Michel, G.
Deposit date:2024-03-14
Release date:2024-07-10
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (2.3 Å)
Cite:Tau filaments with the Alzheimer fold in cases with MAPT mutations V337M and R406W.
Biorxiv, 2024
9EOG
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BU of 9eog by Molmil
PHF type tau filament from R406W mutant
Descriptor: Microtubule-associated protein tau
Authors:Qi, C, Scheres, S.H.W, Michel, G.
Deposit date:2024-03-14
Release date:2024-05-29
Method:ELECTRON MICROSCOPY (3 Å)
Cite:Tau filaments with the Alzheimer fold in cases with MAPT mutations V337M and R406W.
Biorxiv, 2024
9EOH
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BU of 9eoh by Molmil
PHF type tau filament from in vitro V337M mutant
Descriptor: Isoform Tau-F of Microtubule-associated protein tau
Authors:Qi, C, Lovestam, S, Scheres, S.H.W, Michel, G.
Deposit date:2024-03-14
Release date:2024-05-29
Method:ELECTRON MICROSCOPY (2.8 Å)
Cite:Tau filaments with the Alzheimer fold in cases with MAPT mutations V337M and R406W.
Biorxiv, 2024
6M2Z
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BU of 6m2z by Molmil
Crystal structure of a formolase, BFD variant M3 from Pseudomonas putida
Descriptor: Benzoylformate decarboxylase, MAGNESIUM ION, THIAMINE DIPHOSPHATE
Authors:Wei, H.L, Liu, W.D, Li, T.Z, Zhu, L.L.
Deposit date:2020-03-02
Release date:2021-03-03
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Totally atom-economical synthesis of lactic acid from formaldehyde: combined bio-carboligation and chemo-rearrangement without the isolation of intermediate.
Green Chem, 22, 2020
6M2Y
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BU of 6m2y by Molmil
Crystal structure of a formolase, BFD variant M6 from Pseudomonas putida
Descriptor: Benzoylformate decarboxylase, MAGNESIUM ION, THIAMINE DIPHOSPHATE
Authors:Wei, H.L, Liu, W.D, Li, T.Z, Zhu, L.L.
Deposit date:2020-03-02
Release date:2021-03-03
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Totally atom-economical synthesis of lactic acid from formaldehyde: combined bio-carboligation and chemo-rearrangement without the isolation of intermediate.
Green Chem, 22, 2020
4G93
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BU of 4g93 by Molmil
CRYSTAL STRUCTURE OF THE HUMAN HEPATITIS B VIRUS T = 4 CAPSID, ADYW STRAIN, in COMPLEX WITH THE PHENYLPROPENAMIDE ASSEMBLY ACCELERATOR AT-130
Descriptor: Capsid protein, N-[(1E)-1-bromo-1-(2-methoxyphenyl)-3-oxo-3-(piperidin-1-yl)prop-1-en-2-yl]-4-nitrobenzamide
Authors:Katen, S.P, Zlotnick, A.
Deposit date:2012-07-23
Release date:2013-07-24
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (4.2 Å)
Cite:Assembly-directed antivirals differentially bind quasiequivalent pockets to modify hepatitis B virus capsid tertiary and quaternary structure.
Structure, 21, 2013
5TO4
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BU of 5to4 by Molmil
Phospholipase C gamma-1 C-terminal SH2 domain, spacegroup P212121
Descriptor: 1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-1
Authors:Wuttke, D.S, McKercher, M.A.
Deposit date:2016-10-16
Release date:2017-04-19
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Multimodal Recognition of Diverse Peptides by the C-Terminal SH2 Domain of Phospholipase C-gamma 1 Protein.
Biochemistry, 56, 2017
5TQ1
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BU of 5tq1 by Molmil
Phospholipase C gamma-1 C-terminal SH2 domain bound to a phosphopeptide derived from the insulin receptor
Descriptor: 1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-1, Insulin receptor
Authors:Wuttke, D.S, McKercher, M.A.
Deposit date:2016-10-21
Release date:2017-04-19
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.485 Å)
Cite:Multimodal Recognition of Diverse Peptides by the C-Terminal SH2 Domain of Phospholipase C-gamma 1 Protein.
Biochemistry, 56, 2017
5TQS
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BU of 5tqs by Molmil
Phospholipase C gamma-1 C-terminal SH2 domain bound to a phosphopeptide derived from the receptor tyrosine kinase ErbB2
Descriptor: 1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-1, Receptor protein-tyrosine kinase
Authors:Wuttke, D.S, McKercher, M.A.
Deposit date:2016-10-24
Release date:2017-04-19
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.876 Å)
Cite:Multimodal Recognition of Diverse Peptides by the C-Terminal SH2 Domain of Phospholipase C-gamma 1 Protein.
Biochemistry, 56, 2017
5TNW
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BU of 5tnw by Molmil
Phospholipase C gamma-1 C-terminal SH2 domain
Descriptor: 1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-1
Authors:Wuttke, D.S, McKercher, M.A.
Deposit date:2016-10-14
Release date:2017-04-19
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Multimodal Recognition of Diverse Peptides by the C-Terminal SH2 Domain of Phospholipase C-gamma 1 Protein.
Biochemistry, 56, 2017
5W3R
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BU of 5w3r by Molmil
SH2B1 SH2 Domain
Descriptor: PHENOL, PHOSPHATE ION, SH2B adapter protein 1
Authors:McKercher, M.A, Wuttke, D.S.
Deposit date:2017-06-08
Release date:2017-11-22
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.386 Å)
Cite:Diversity in peptide recognition by the SH2 domain of SH2B1.
Proteins, 86, 2018
7LTN
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BU of 7ltn by Molmil
Crystal structure of Mpro in complex with inhibitor CDD-1713
Descriptor: 2-[4-(1~{H}-indazol-4-yl)-2-methanoyl-6-methoxy-phenoxy]-~{N},~{N}-dimethyl-ethanamide, 3C-like proteinase
Authors:Lu, S, Palzkill, T, Matzuk, M, Young, D, Melek, N, Chamakuri, S.
Deposit date:2021-02-19
Release date:2021-11-10
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:DNA-encoded chemistry technology yields expedient access to SARS-CoV-2 M pro inhibitors.
Proc.Natl.Acad.Sci.USA, 118, 2021
8G1T
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BU of 8g1t by Molmil
Crystal structure of Bax core domain BH3-groove dimer - tetrameric fraction P21
Descriptor: 1,2-ETHANEDIOL, Apoptosis regulator BAX
Authors:Cowan, A.D, Colman, P.M, Czabotar, P.E, Miller, M.S.
Deposit date:2023-02-02
Release date:2023-12-27
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (2.092 Å)
Cite:Sequence differences between BAX and BAK core domains manifest as differences in their interactions with lipids.
Febs J., 291, 2024
7TJE
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BU of 7tje by Molmil
Bacteriophage Q beta capsid protein A38K
Descriptor: Minor capsid protein A1
Authors:Jin, X.
Deposit date:2022-01-16
Release date:2023-01-25
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.799 Å)
Cite:Alternative Assembly of Q beta Virus-like Particles
To Be Published

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