Mine: New entries

6LF3
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3D DOMAIN-SWAPPED DIMER OF THE MALTOSE-BINDING PROTEIN FUSED TO A FRAGMENT OF THE PROTEIN-TYROSINE KINASE 2-BETA
Descriptor:Maltose/maltodextrin-binding periplasmic protein,Protein-tyrosine kinase 2-beta, MALTOSE
Authors:Momin, A.A., Shahul Hameed, U.F., Arold, S.T.
Deposit date:2019-11-28
Release date:2019-12-11
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:Passenger sequences can promote interlaced dimers in a common variant of the maltose-binding protein
To be published
6V45
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CRYSTAL STRUCTURE OF A PROBABLE CARNITINE OPERON OXIDOREDUCTASE CAIA FROM BRUCELLA MELITENSIS
Descriptor:Probable carnitine operon oxidoreductase caia, SULFATE ION
Authors:Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:2019-11-27
Release date:2019-12-11
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Crystal structure of a Probable carnitine operon oxidoreductase caia from Brucella melitensis
to be published
6LES
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3D DOMAIN-SWAPPED DIMER OF THE MALTOSE-BINDING PROTEIN FUSED TO A FRAGMENT OF THE FOCAL ADHESION KINASE
Descriptor:Maltose/maltodextrin-binding periplasmic protein,Focal adhesion kinase 1, SULFATE ION
Authors:Momin, A.A., Shahul Hameed, U.F., Arold, S.T.
Deposit date:2019-11-26
Release date:2019-12-11
Method:X-RAY DIFFRACTION (2.004 Å)
Cite:Passenger sequences can promote interlaced dimers in a common variant of the maltose-binding protein
to be published
6V2L
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E. COLI PHOSPHOENOLPYRUVATE CARBOXYKINASE S250A
Descriptor:Phosphoenolpyruvate carboxykinase (ATP), ADENOSINE-5'-TRIPHOSPHATE, ACETATE ION, ...
Authors:Sokaribo, A.S., Goldie, H., Sanders, D.
Deposit date:2019-11-25
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:E. coli phosphoenolpyruvate carboxykinase S250A mutant
To Be Published
6V2M
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STRUCTURE OF ESCHERICHIA COLI ASP269ASN MUTANT PHOSPHOENOLPYRUVATE CARBOXYKINASE
Descriptor:Phosphoenolpyruvate carboxykinase (ATP), ADENOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, ...
Authors:Sokaribo, A.S., Cotelesage, J.H.
Deposit date:2019-11-25
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.66 Å)
Cite:Structure of Escherichia coli Asp269Asn mutant phosphoenolpyruvate carboxykinase
To Be Published
6V1T
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EMPTY AAVRH.39 PARTICLE
Descriptor:Capsid protein VP1
Authors:Mietzsch, M., Agbandje-McKenna, M.
Deposit date:2019-11-21
Release date:2019-12-11
Method:ELECTRON MICROSCOPY (3.39 Å)
Cite:Comparative Analysis of the Capsid Structures of AAVrh.10, AAVrh.39, and AAV8
to be published
6V1Z
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GENOME-CONTAINING AAVRH.39 PARTICLES
Descriptor:Capsid protein VP1, 2'-DEOXYCYTIDINE-5'-MONOPHOSPHATE, 2'-DEOXYADENOSINE-5'-MONOPHOSPHATE
Authors:Mietzsch, M., Agbandje-McKenna, M.
Deposit date:2019-11-21
Release date:2019-12-11
Method:ELECTRON MICROSCOPY (3.58 Å)
Cite:Comparative Analysis of the Capsid Structures of AAVrh.10, AAVrh.39, and AAV8
to be published
6V1C
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CRYSTAL STRUCTURE OF HUMAN TREFOIL FACTOR 3 IN COMPLEX WITH ITS COGNATE LIGAND
Descriptor:Trefoil factor 3, N/A4-O-[2-(ACETYLAMINO)-2-DEOXY-ALPHA-D-GLUCOPYRANOSYL]-BETA-D-GALACTOPYRANOSE
Authors:Jarva, M.A., Lingford, J.P., John, A., Scott, N.E., Goddard-Borger, E.D.
Deposit date:2019-11-20
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Trefoil factors share a lectin activity that defines their role in mucus
Biorxiv, 2019
6V1D
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CRYSTAL STRUCTURE OF HUMAN TREFOIL FACTOR 1
Descriptor:Trefoil factor 1
Authors:Jarva, M.A., Lingford, J.P., John, A., Scott, N.E., Goddard-Borger, E.D.
Deposit date:2019-11-20
Release date:2019-12-11
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Trefoil factors share a lectin activity that defines their role in mucus
Biorxiv, 2019
6V1G
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GENOME-CONTAINING AAVRH.10
Descriptor:Capsid protein VP1, 2'-DEOXYCYTIDINE-5'-MONOPHOSPHATE, 2'-DEOXYADENOSINE-5'-MONOPHOSPHATE
Authors:Mietzsch, M., Agbandje-McKenna, M.
Deposit date:2019-11-20
Release date:2019-12-11
Method:ELECTRON MICROSCOPY (2.98 Å)
Cite:Comparative Analysis of the Capsid Structures of AAVrh.10, AAVrh.39, and AAV8
To be Published
6V10
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GENOME-CONTAINING AAV8 PARTICLES
Descriptor:Capsid protein, 2'-DEOXYCYTIDINE-5'-MONOPHOSPHATE, 2'-DEOXYADENOSINE-5'-MONOPHOSPHATE
Authors:Mietzsch, M., Agbandje-McKenna, M.
Deposit date:2019-11-19
Release date:2019-12-11
Method:ELECTRON MICROSCOPY (3.77 Å)
Cite:Comparative Analysis of the Capsid Structures of AAVrh.10, AAVrh.39, and AAV8
to be published
6V12
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EMPTY AAV8 PARTICLES
Descriptor:Capsid protein
Authors:Mietzsch, M., Agbandje-McKenna, M.
Deposit date:2019-11-19
Release date:2019-12-11
Method:ELECTRON MICROSCOPY (3.08 Å)
Cite:Comparative Analysis of the Capsid Structures of AAVrh.10, AAVrh.39, and AAV8
to be published
6TF9
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STRUCTURE OF THE VERTEBRATE GAMMA-TUBULIN RING COMPLEX
Descriptor:Helix 1, Belt helices 1,2,3,4, Belt helix 5, ...
Authors:Zupa, E., Pfeffer, S.
Deposit date:2019-11-13
Release date:2019-12-11
Method:ELECTRON MICROSCOPY (4.8 Å)
Cite:Structural insights into assembly and activation of the general microtubule nucleator gamma-TuRC
To Be Published
6TEL
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CRYSTAL STRUCTURE OF DOT1L IN COMPLEX WITH AN INHIBITOR (COMPOUND 10).
Descriptor:Histone-lysine N-methyltransferase, H3 lysine-79 specific, ~{N}1-[(~{S})-[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]-(3-chloranylpyridin-2-yl)methyl]-~{N}2-(4-methoxy-6-piperazin-1-yl-1,3,5-triazin-2-yl)-4-methylsulfonyl-benzene-1,2-diamine, ...
Authors:Scheufler, C., Stauffer, F., Be, C., Moebitz, H.
Deposit date:2019-11-12
Release date:2019-12-11
Method:X-RAY DIFFRACTION (2.19 Å)
Cite:New Potent DOT1L Inhibitors for in Vivo Evaluation in Mouse
Acs Med.Chem.Lett., 2019
6TEN
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CRYSTAL STRUCTURE OF DOT1L IN COMPLEX WITH AN INHIBITOR (COMPOUND 11).
Descriptor:Histone-lysine N-methyltransferase, H3 lysine-79 specific, 3-[(4-azanyl-6-methoxy-1,3,5-triazin-2-yl)amino]-4-[[(~{S})-[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]-(3-chloranylpyridin-2-yl)methyl]amino]benzenesulfonamide, ...
Authors:Scheufler, C., Stauffer, F., Be, C., Moebitz, H.
Deposit date:2019-11-12
Release date:2019-12-11
Method:X-RAY DIFFRACTION (2.21 Å)
Cite:New Potent DOT1L Inhibitors for in Vivo Evaluation in Mouse
Acs Med.Chem.Lett., 2019
6TE6
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CRYSTAL STRUCTURE OF DOT1L IN COMPLEX WITH AN INHIBITOR (COMPOUND 3).
Descriptor:Histone-lysine N-methyltransferase, H3 lysine-79 specific, ~{N}1-[(~{S})-(3-chlorophenyl)-pyridin-2-yl-methyl]-4-methylsulfonyl-~{N}2-pyrimidin-2-yl-benzene-1,2-diamine
Authors:Scheufler, C., Stauffer, F., Be, C., Moebitz, H.
Deposit date:2019-11-11
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.98 Å)
Cite:New Potent DOT1L Inhibitors for in Vivo Evaluation in Mouse
Acs Med.Chem.Lett., 2019
6L9F
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CRYSTAL STRUCTURE OF TEAD4 IN COMPLEX WITH A NOVEL FAM181A PEPTIDE
Descriptor:Transcriptional enhancer factor TEF-3, Protein FAM181A, ACETATE ION
Authors:Chen, M., Zhou, Z.
Deposit date:2019-11-09
Release date:2019-12-11
Method:X-RAY DIFFRACTION (2.555 Å)
Cite:Crystal structure of TEAD4 in complex with a novel FAM181A peptide
To be published
6L92
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A BASKET TYPE G-QUADRUPLEX IN WNT DNA PROMOTER
Descriptor:DNA (5'-D(*GP*GP*GP*CP*CP*AP*CP*CP*GP*GP*GP*CP*AP*GP*TP*GP*GP*GP*CP*GP*GP*G)-3')
Authors:Wang, Z.F., Li, M.H., Chu, I.T., Winnerdy, F.R., Phan, A.T., Chang, T.C.
Deposit date:2019-11-08
Release date:2019-12-11
Method:SOLUTION NMR
Cite:Cytosine epigenetic modification modulates the formation of an unprecedented G4 structure in the WNT1 promoter
To Be Published
6L8M
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WNT DNA PROMOTER MUTANT G-QUADRUPLEX
Descriptor:DNA (5'-D(*GP*GP*GP*TP*CP*AP*CP*CP*GP*GP*GP*CP*AP*GP*TP*GP*GP*GP*CP*GP*GP*G)-3')
Authors:Wang, Z.F., Li, M.H., Chu, I.T., Winnerdy, F.R., Phan, A.T., Chang, T.C.
Deposit date:2019-11-06
Release date:2019-12-11
Method:SOLUTION NMR
Cite:Cytosine epigenetic modification modulates the formation of an unprecedented G4 structure in the WNT1 promoter
To Be Published
6UWP
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BACE-1 IN COMPLEX WITH COMPOUND #32
Descriptor:Beta-secretase 1, (1R,2R)-2-[(4aR,7aR)-2-amino-6-(pyrimidin-2-yl)-4a,5,6,7-tetrahydropyrrolo[3,4-d][1,3]thiazin-7a(4H)-yl]-N-{[(1R,2R)-2-methylcyclopropyl]methyl}cyclopropane-1-carboxamide, GLYCEROL, ...
Authors:Hendle, J., Timm, D.E.
Deposit date:2019-11-05
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.29 Å)
Cite:Preparation and biological evaluation of BACE1 inhibitors: Leveraging trans-cyclopropyl moieties as ligand efficient conformational constraints.
Bioorg.Med.Chem., 2019
6UWV
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BACE-1 IN COMPLEX WITH COMPOUND #34
Descriptor:Beta-secretase 1, (4aR,7aR)-7a-[(1R,2R)-2-(2-{[(1R,2R)-2-methylcyclopropyl]methoxy}propan-2-yl)cyclopropyl]-6-(pyrimidin-2-yl)-4,4a,5,6,7,7a-hexahydropyrrolo[3,4-d][1,3]thiazin-2-amine, GLYCEROL, ...
Authors:Hendle, J., Stout, S.L.
Deposit date:2019-11-05
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.47 Å)
Cite:Preparation and biological evaluation of BACE1 inhibitors: Leveraging trans-cyclopropyl moieties as ligand efficient conformational constraints.
Bioorg.Med.Chem., 2019
6UVP
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BACE-1 IN COMPLEX WITH COMPOUND #3
Descriptor:Beta-secretase 1, N-{(1S,2S)-2-[(4aS,7aR)-2-amino-4a,5-dihydro-4H-furo[3,4-d][1,3]thiazin-7a(7H)-yl]cyclopropyl}-5-fluoropyridine-2-carboxamide, N-{(1R,2R)-2-[(4aS,7aR)-2-amino-4a,5-dihydro-4H-furo[3,4-d][1,3]thiazin-7a(7H)-yl]cyclopropyl}-5-fluoropyridine-2-carboxamide, ...
Authors:Hendle, J., Timm, D.E.
Deposit date:2019-11-04
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.56 Å)
Cite:Preparation and biological evaluation of BACE1 inhibitors: Leveraging trans-cyclopropyl moieties as ligand efficient conformational constraints.
Bioorg.Med.Chem., 2019
6UVV
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BACE-1 IN COMPLEX WITH COMPOUND #17
Descriptor:Beta-secretase 1, (1R,2R)-2-[(4aS,7aR)-2-amino-4a,5-dihydro-4H-furo[3,4-d][1,3]thiazin-7a(7H)-yl]-N-butylcyclopropane-1-carboxamide, GLYCEROL, ...
Authors:Hendle, J., Timm, D.E.
Deposit date:2019-11-04
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.63 Å)
Cite:Preparation and biological evaluation of BACE1 inhibitors: Leveraging trans-cyclopropyl moieties as ligand efficient conformational constraints.
Bioorg.Med.Chem., 2019
6UVY
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BACE-1 IN COMPLEX WITH COMPOUND #18
Descriptor:Beta-secretase 1, (1R,2R)-2-[(4aS,7aR)-2-amino-4a,5-dihydro-4H-furo[3,4-d][1,3]thiazin-7a(7H)-yl]-N-{[(1R,2R)-2-methylcyclopropyl]methyl}cyclopropane-1-carboxamide, GLYCEROL, ...
Authors:Hendle, J., Timm, D.E.
Deposit date:2019-11-04
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.71 Å)
Cite:Preparation and biological evaluation of BACE1 inhibitors: Leveraging trans-cyclopropyl moieties as ligand efficient conformational constraints.
Bioorg.Med.Chem., 2019
6T9Y
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CARBOXYPEPTIDASE T WITH N-SULFAMOYL-L-LYSIN
Descriptor:Carboxypeptidase T, (2~{S})-6-azanyl-2-(sulfamoylamino)hexanoic acid, ZINC ION, ...
Authors:Timofeev, V.I., Akparov, V.K., Kuranova, I.P.
Deposit date:2019-10-29
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.92 Å)
Cite:CARBOXYPEPTIDASE T WITH N-SULFAMOYL-L-LYSIN
To Be Published