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8V31
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Structure of Alistipes sp. 3-Keto-2-hydroxy-glucal-hydratase AL2
Descriptor: Glycosyl hydrolase, MAGNESIUM ION
Authors:Lazarski, A.C, Worrall, L.J, Strynadka, N.C.J.
Deposit date:2023-11-25
Release date:2024-06-19
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:An alternative broad-specificity pathway for glycan breakdown in bacteria
To Be Published
8V2W
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BU of 8v2w by Molmil
Crystal Structure of the ancestral triosephosphate isomerase reconstruction of the last opisthokont common ancestor obtained by Bayesian inference
Descriptor: GLYCEROL, Triosephosphate isomerase
Authors:Perez-Nino, J.A, Rodriguez-Romero, A, Guerra, Y, Fernandez-Velasco, D.A.
Deposit date:2023-11-24
Release date:2024-09-04
Method:X-RAY DIFFRACTION (1.38 Å)
Cite:Stable monomers in the ancestral sequence reconstruction of the last opisthokont common ancestor of dimeric triosephosphate isomerase.
Protein Sci., 33, 2024
8V2T
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BU of 8v2t by Molmil
Phosphoheptose isomerase GMHA from Burkholderia pseudomallei bound to inhibitor Mut148591
Descriptor: 1,5,6-trideoxy-6,6-difluoro-1-(N-hydroxyformamido)-6-phosphono-D-ribo-hexitol, CHLORIDE ION, Phosphoheptose isomerase, ...
Authors:Junop, M.S, Brown, C, Szabla, R.
Deposit date:2023-11-23
Release date:2023-12-06
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (1.402 Å)
Cite:Potentiating Activity of GmhA Inhibitors on Gram-Negative Bacteria.
J.Med.Chem., 67, 2024
8V2L
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BU of 8v2l by Molmil
Crystal structure of IRAK4 kinase domain with compound 8
Descriptor: 1,2-ETHANEDIOL, Interleukin-1 receptor-associated kinase 4, N-{2-[4-(hydroxymethyl)phenyl]-6-(2-hydroxypropan-2-yl)-2H-indazol-5-yl}-6-(trifluoromethyl)pyridine-2-carboxamide
Authors:Weiss, M.M, Zheng, X, Browne, C.M, Campbell, V, Chen, D, Enerson, B, Fei, X, Huang, X, Klaus, C.R, Li, H, Mayo, M, McDonald, A.A, Paul, A, Sharma, K, Shi, Y, Slavin, A, Walter, D.M, Yuan, K, Zhang, Y, Zhu, X, Kelleher, J, Ji, N, Walker, D, Mainolfi, N.
Deposit date:2023-11-22
Release date:2024-07-03
Last modified:2024-07-24
Method:X-RAY DIFFRACTION (2.43 Å)
Cite:Discovery of KT-413, a Targeted Protein Degrader of IRAK4 and IMiD Substrates Targeting MYD88 Mutant Diffuse Large B-Cell Lymphoma.
J.Med.Chem., 67, 2024
8V2K
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Proteus vulgaris tryptophan indole-lyase complexed with L-alanine
Descriptor: (2E)-2-{[(Z)-{3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4(1H)-YLIDENE}METHYL]IMINO}PROPANOIC ACID, (E)-N-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methylidene)-L-alanine, DIMETHYL SULFOXIDE, ...
Authors:Phillips, R.S.
Deposit date:2023-11-22
Release date:2023-12-06
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:Proteus vulgaris tryptophan indole-lyase complexed with L-alanine
To Be Published
8V2F
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BU of 8v2f by Molmil
Crystal structure of IRAK4 kinase domain with compound 9
Descriptor: CHLORIDE ION, GLYCEROL, Interleukin-1 receptor-associated kinase 4, ...
Authors:Weiss, M.M, Zheng, X, Browne, C.M, Campbell, V, Chen, D, Enerson, B, Fei, X, Huang, X, Klaus, C.R, Li, H, Mayo, M, McDonald, A.A, Paul, A, Sharma, K, Shi, Y, Slavin, A, Walter, D.M, Yuan, K, Zhang, Y, Zhu, X, Kelleher, J, Ji, N, Walker, D, Mainolfi, N.
Deposit date:2023-11-22
Release date:2024-07-03
Last modified:2024-07-24
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:Discovery of KT-413, a Targeted Protein Degrader of IRAK4 and IMiD Substrates Targeting MYD88 Mutant Diffuse Large B-Cell Lymphoma.
J.Med.Chem., 67, 2024
8V2D
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BU of 8v2d by Molmil
Computational Designed Nanocage O43_129
Descriptor: O43_129 component A, O43_129 component B
Authors:Weidle, C, Kibler, R.D.
Deposit date:2023-11-22
Release date:2024-03-13
Last modified:2024-04-10
Method:ELECTRON MICROSCOPY (6.77 Å)
Cite:Blueprinting extendable nanomaterials with standardized protein blocks.
Nature, 627, 2024
8V1T
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BU of 8v1t by Molmil
Herpes simplex virus 1 polymerase holoenzyme bound to DNA and acyclovir triphosphate in closed conformation
Descriptor: ACYCLOVIR TRIPHOSPHATE, DNA polymerase, DNA polymerase processivity factor, ...
Authors:Pan, J, Abraham, J, Coen, D.M, Shankar, S, Yang, P, Hogle, J.
Deposit date:2023-11-21
Release date:2024-09-04
Last modified:2024-09-11
Method:ELECTRON MICROSCOPY (2.8 Å)
Cite:Viral DNA polymerase structures reveal mechanisms of antiviral drug resistance.
Cell, 2024
8V1S
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BU of 8v1s by Molmil
Herpes simplex virus 1 polymerase holoenzyme bound to mismatched DNA in editing conformation
Descriptor: DNA polymerase, DNA polymerase processivity factor, MAGNESIUM ION, ...
Authors:Pan, J, Abraham, J, Coen, D.M, Shankar, S, Yang, P, Hogle, J.
Deposit date:2023-11-21
Release date:2024-09-04
Last modified:2024-09-11
Method:ELECTRON MICROSCOPY (3.26 Å)
Cite:Viral DNA polymerase structures reveal mechanisms of antiviral drug resistance.
Cell, 2024
8V1R
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BU of 8v1r by Molmil
Herpes simplex virus 1 polymerase holoenzyme bound to DNA and DTTP in closed conformation
Descriptor: DNA polymerase, DNA polymerase processivity factor, MAGNESIUM ION, ...
Authors:Pan, J, Abraham, J, Coen, D.M, Shankar, S, Yang, P, Hogle, J.
Deposit date:2023-11-21
Release date:2024-09-04
Last modified:2024-09-11
Method:ELECTRON MICROSCOPY (2.9 Å)
Cite:Viral DNA polymerase structures reveal mechanisms of antiviral drug resistance.
Cell, 2024
8V1Q
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BU of 8v1q by Molmil
Herpes simplex virus 1 polymerase holoenzyme bound to DNA in both open/closed conformations
Descriptor: DNA polymerase, DNA polymerase processivity factor, MAGNESIUM ION, ...
Authors:Pan, J, Abraham, J, Coen, D.M, Shankar, S, Yang, P, Hogle, J.
Deposit date:2023-11-21
Release date:2024-09-04
Last modified:2024-09-11
Method:ELECTRON MICROSCOPY (2.7 Å)
Cite:Viral DNA polymerase structures reveal mechanisms of antiviral drug resistance.
Cell, 2024
8V1O
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BU of 8v1o by Molmil
Crystal structure of IRAK4 kinase domain with compound 4
Descriptor: CHLORIDE ION, GLYCEROL, Interleukin-1 receptor-associated kinase 4, ...
Authors:Weiss, M.M, Zheng, X, Browne, C.M, Campbell, V, Chen, D, Enerson, B, Fei, X, Huang, X, Klaus, C.R, Li, H, Mayo, M, McDonald, A.A, Paul, A, Sharma, K, Shi, Y, Slavin, A, Walter, D.M, Yuan, K, Zhang, Y, Zhu, X, Kelleher, J, Ji, N, Walker, D, Mainolfi, N.
Deposit date:2023-11-21
Release date:2024-07-03
Last modified:2024-07-24
Method:X-RAY DIFFRACTION (2.92 Å)
Cite:Discovery of KT-413, a Targeted Protein Degrader of IRAK4 and IMiD Substrates Targeting MYD88 Mutant Diffuse Large B-Cell Lymphoma.
J.Med.Chem., 67, 2024
8V1K
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BU of 8v1k by Molmil
Crystal structure of outer membrane lipoprotein carrier protein (LolA) from Francisella tularensis
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, Outer-membrane lipoprotein carrier protein
Authors:Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:2023-11-20
Release date:2023-11-29
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure of outer membrane lipoprotein carrier protein (LolA) from Francisella tularensis
To be published
8V1J
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BU of 8v1j by Molmil
Structure of an allelic variant of Puccinia graminis f. sp. tritici (Pgt) effector AvrSr27 (AvrSr27-1)
Descriptor: AvrSr27, ZINC ION
Authors:Outram, M.A, Williams, S.J, Ericsson, D.J.
Deposit date:2023-11-20
Release date:2024-06-12
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (2.41596365 Å)
Cite:AvrSr27 is a zinc-bound effector with a modular structure important for immune recognition.
New Phytol., 243, 2024
8V1I
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BU of 8v1i by Molmil
Crystal structure of human mascRNA
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, CALCIUM ION, ...
Authors:Skeparnias, I, Zhang, J.
Deposit date:2023-11-20
Release date:2024-07-10
Last modified:2024-07-17
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural basis of MALAT1 RNA maturation and mascRNA biogenesis.
Nat.Struct.Mol.Biol., 2024
8V11
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BU of 8v11 by Molmil
Structure of a Saccharomyces cerevisiae Ipl1 peptide Bound to dwarf Ndc80 complex
Descriptor: Ipl1/Nuf2 chimera protein, Kinetochore protein NDC80, Kinetochore protein SPC24, ...
Authors:Zahm, J.A, Harrison, S.C.
Deposit date:2023-11-19
Release date:2024-05-15
Last modified:2024-06-12
Method:X-RAY DIFFRACTION (3.95 Å)
Cite:A communication hub for phosphoregulation of kinetochore-microtubule attachment.
Curr.Biol., 34, 2024
8V10
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BU of 8v10 by Molmil
Structure of a Saccharomyces cerevisiae Mps1 peptide bound to dwarf Ndc80 Complex
Descriptor: Kinetochore protein NDC80, Kinetochore protein SPC24, Kinetochore protein SPC25, ...
Authors:Zahm, J.A, Harrison, S.C.
Deposit date:2023-11-19
Release date:2024-05-15
Last modified:2024-06-12
Method:X-RAY DIFFRACTION (3.02 Å)
Cite:A communication hub for phosphoregulation of kinetochore-microtubule attachment.
Curr.Biol., 34, 2024
8V07
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BU of 8v07 by Molmil
Crystal structure of mouse PLD3 co-crystallized with 5'Pi-ssDNA for 30 days
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 5'-3' exonuclease PLD3, ...
Authors:Yuan, M, Wilson, I.A.
Deposit date:2023-11-17
Release date:2024-03-13
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Structural and mechanistic insights into disease-associated endolysosomal exonucleases PLD3 and PLD4.
Structure, 32, 2024
8UZT
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BU of 8uzt by Molmil
Mitochondrial single-stranded binding protein bound to DNA
Descriptor: GLYCEROL, SODIUM ION, Single-stranded DNA-binding protein, ...
Authors:Riccio, A.A, Pedersen, L.C, Bouvette, J, Borgnia, J.M, Copeland, W.C.
Deposit date:2023-11-16
Release date:2024-08-21
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structures of the mitochondrial single-stranded DNA binding protein with DNA and DNA polymerase gamma.
Nucleic Acids Res., 2024
8UZH
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BU of 8uzh by Molmil
SUMO fused Trehalose Synthase (TreS) of Mycobacterium tuberculosis
Descriptor: CALCIUM ION, SUMO fused Trehalose Synthase (TreS),Trehalose synthase/amylase TreS
Authors:Pathirage, R, Ronning, D.R.
Deposit date:2023-11-15
Release date:2024-03-27
Last modified:2024-04-24
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Targeting Mycobacterium tuberculosis Persistence through Inhibition of the Trehalose Catalytic Shift.
Acs Infect Dis., 10, 2024
8UZ8
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BU of 8uz8 by Molmil
Crystal Structure of CiaD from Campylobacter jejuni (C-terminal fragment, Orthorhombic P form)
Descriptor: 1,4-BUTANEDIOL, 2-oxoglutarate:acceptor oxidoreductase, CHLORIDE ION, ...
Authors:Seattle Structural Genomics Center for Infectious Disease, Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:2023-11-14
Release date:2023-12-06
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Crystal Structure of CiaD from Campylobacter jejuni (C-terminal fragment, Orthorhombic P form)
To be published
8UY2
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BU of 8uy2 by Molmil
Methylenetetrahydrofolate reductase from Chaetomium thermophilum DSM 1495, AdoMet-bound, Inhibited (T) State
Descriptor: ACETATE ION, FLAVIN-ADENINE DINUCLEOTIDE, GLYCEROL, ...
Authors:Yamada, K, Mendoza, J, Koutmos, M.
Deposit date:2023-11-12
Release date:2024-06-19
Last modified:2024-07-03
Method:X-RAY DIFFRACTION (2.83 Å)
Cite:Structural basis of S-adenosylmethionine-dependent allosteric transition from active to inactive states in methylenetetrahydrofolate reductase.
Nat Commun, 15, 2024
8UXM
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BU of 8uxm by Molmil
Structure of PKA phosphorylated human RyR2-R420W in the open state in the presence of calcium and calmodulin
Descriptor: ADENOSINE-5'-TRIPHOSPHATE, CALCIUM ION, Calmodulin-1, ...
Authors:Miotto, M.C, Marks, A.R.
Deposit date:2023-11-09
Release date:2023-11-22
Method:ELECTRON MICROSCOPY (3.56 Å)
Cite:Structural basis for ryanodine receptor type 2 leak in heart failure and arrhythmogenic disorders
To Be Published
8UXL
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Structure of PKA phosphorylated human RyR2-R420W in the primed state in the presence of calcium and calmodulin
Descriptor: ADENOSINE-5'-TRIPHOSPHATE, CALCIUM ION, Calmodulin-1, ...
Authors:Miotto, M.C, Marks, A.R.
Deposit date:2023-11-09
Release date:2023-11-22
Method:ELECTRON MICROSCOPY (3.12 Å)
Cite:Structural basis for ryanodine receptor type 2 leak in heart failure and arrhythmogenic disorders
To Be Published
8UXI
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BU of 8uxi by Molmil
Structure of PKA phosphorylated human RyR2-R420W in the open state in the presence of calcium
Descriptor: ADENOSINE-5'-TRIPHOSPHATE, CALCIUM ION, Peptidyl-prolyl cis-trans isomerase FKBP1B, ...
Authors:Miotto, M.C, Marks, A.R.
Deposit date:2023-11-09
Release date:2023-11-22
Method:ELECTRON MICROSCOPY (3.29 Å)
Cite:Structural basis for ryanodine receptor type 2 leak in heart failure and arrhythmogenic disorders
To Be Published

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PDB entries from 2024-09-11

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