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9NJX
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BU of 9njx by Molmil
[0,7,12-->14] Shifted tensegrity triangle with an (arm,center,arm) distribution of (0,7,12) base pairs and 2 nt sticky ends containing a semi-junction that becomes left-handed
Descriptor: DNA (5'-D(*GP*AP*AP*TP*GP*CP*GP*TP*AP*GP*CP*TP*GP*T)-3'), DNA (5'-D(*TP*CP*TP*GP*TP*A)-3'), DNA (5'-D(P*AP*CP*AP*CP*CP*GP*T)-3'), ...
Authors:Horvath, A, Vecchioni, S, Woloszyn, K, Ohayon, Y.P, Sha, R.
Deposit date:2025-02-28
Release date:2025-06-11
Method:X-RAY DIFFRACTION (4.58 Å)
Cite:Shifted tensegrity triangles
To Be Published
9M5N
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BU of 9m5n by Molmil
Plasmodium vivax aspartyl-tRNA synthetase in complex with aspartyl-adenylate (Asp-AMP) Complex.
Descriptor: ACETATE ION, ASPARTYL-ADENOSINE-5'-MONOPHOSPHATE, GLYCEROL, ...
Authors:Sharma, V.K, Manickam, Y, Sharma, A, Bagale, S, Pradeepkumar, P.I.
Deposit date:2025-03-06
Release date:2025-06-04
Method:X-RAY DIFFRACTION (2.14 Å)
Cite:Natural product-mediated reaction hijacking mechanism validates Plasmodium aspartyl-tRNA synthetase as an antimalarial drug target
To Be Published
9N5X
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BU of 9n5x by Molmil
The capsid structure of AAVpo.1
Descriptor: VP3
Authors:Nelson, A, Mietzsch, M, McKenna, R.
Deposit date:2025-02-04
Release date:2025-04-16
Method:ELECTRON MICROSCOPY (1.79 Å)
Cite:Structural insights into porcine adeno-associated viruses
To Be Published
9NFM
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BU of 9nfm by Molmil
Tuna P-glycoprotein bound to DDT
Descriptor: 1-chloranyl-4-[2,2,2-tris(chloranyl)-1-(4-chlorophenyl)ethyl]benzene, Permeability Glycoprotein (P-gp)
Authors:Young, M.A, Rees, S.D, Nicklisch, S.C.T, Stowell, M, Hamdoun, A, Chang, G.
Deposit date:2025-02-21
Release date:2025-06-04
Last modified:2025-06-18
Method:ELECTRON MICROSCOPY (3.89 Å)
Cite:Cryo-EM Structures of Apo and DDT-Bound P-Glycoprotein in Yellowfin Tuna.
Environ Sci Technol., 59, 2025
9NFI
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BU of 9nfi by Molmil
Tuna P-glycoprotein Apo Conformation 1
Descriptor: Permeability Glycoprotein (P-gp)
Authors:Young, M.A, Rees, S.D, Nicklisch, S.C.T, Stowell, M, Hamdoun, A, Chang, G, Center for Structures of Membrane Proteins (CSMP)
Deposit date:2025-02-21
Release date:2025-06-04
Last modified:2025-06-18
Method:ELECTRON MICROSCOPY (3.79 Å)
Cite:Cryo-EM Structures of Apo and DDT-Bound P-Glycoprotein in Yellowfin Tuna.
Environ Sci Technol., 59, 2025
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:2025-06-04
Method:ELECTRON MICROSCOPY (3.8 Å)
Cite:Structure of a new capsid form and comparison with A-, B- and C-capsids clarify herpesvirus assembly
To Be Published
9NPV
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BU of 9npv by Molmil
[4,8,7-2] Shifted tensegrity triangle with an (arm,center,arm) distribution of (4,8,7) base pairs and 2 nt sticky ends
Descriptor: DNA (5'-D(*GP*AP*GP*AP*GP*CP*TP*GP*TP*G)-3'), DNA (5'-D(*TP*CP*TP*GP*AP*TP*CP*GP*TP*GP*CP*TP*C)-3'), DNA (5'-D(P*AP*CP*GP*GP*AP*CP*GP*AP*TP*CP*A)-3'), ...
Authors:Horvath, A, Vecchioni, S, Woloszyn, K, Ohayon, Y.P, Sha, R.
Deposit date:2025-03-11
Release date:2025-04-30
Method:X-RAY DIFFRACTION (3 Å)
Cite:Shifted tensegrity triangles
To Be Published
9NOG
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BU of 9nog by Molmil
[0,6,13-2] Shifted DNA assembly with an aspect ratio of (0,6,13) base pairs and 2 nt sticky ends containing a semi-junction
Descriptor: DNA (5'-D(*GP*AP*TP*GP*CP*GP*AP*GP*GP*TP*GP*CP*TP*GP*T)-3'), DNA (5'-D(*TP*CP*TP*GP*TP*CP*GP*GP*AP*CP*AP*GP*CP*AP*CP*CP*TP*CP*GP*CP*A)-3'), DNA (5'-D(P*CP*CP*G)-3')
Authors:Horvath, A, Woloszyn, K, Vecchioni, S, Ohayon, Y.P, Sha, R.
Deposit date:2025-03-10
Release date:2025-07-02
Method:X-RAY DIFFRACTION (4.89 Å)
Cite:shifted tensegrity triangles
To Be Published
9NOF
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BU of 9nof by Molmil
[7,7,6-1] Shifted tensegrity triangle with an (arm,center,arm) distribution of (7,7,6) base pairs and 1 nt sticky ends, with hexagonal symmetry
Descriptor: DNA (5'-D(*CP*TP*GP*AP*TP*GP*TP*GP*GP*CP*TP*GP*CP*T)-3'), DNA (5'-D(*GP*AP*GP*CP*AP*GP*CP*CP*TP*GP*TP*A)-3'), DNA (5'-D(P*AP*CP*AP*CP*CP*GP*T)-3'), ...
Authors:Abi Rizk, J, Horvath, A, Vecchioni, S, Woloszyn, K, Ohayon, Y.P, Sha, R.
Deposit date:2025-03-10
Release date:2025-07-02
Method:X-RAY DIFFRACTION (4.08 Å)
Cite:Shifted tensegrity triangles
To Be Published
9M5O
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BU of 9m5o by Molmil
Plasmodium vivax aspartyl-tRNA synthetase in complex with aspartyl sulfamoyl adenosine (Asp-AMS) Complex
Descriptor: 5'-O-(L-alpha-aspartylsulfamoyl)adenosine, MAGNESIUM ION, aspartate--tRNA ligase
Authors:Sharma, V.K, Manickam, Y, Sharma, A, Bagale, S, Pradeepkumar, P.I.
Deposit date:2025-03-06
Release date:2025-06-04
Method:X-RAY DIFFRACTION (1.839 Å)
Cite:Natural product-mediated reaction hijacking mechanism validates Plasmodium aspartyl-tRNA synthetase as an antimalarial drug target
To Be Published
9NIU
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BU of 9niu by Molmil
Co-crystal structure of FABP7 in complex with PFO3TDA
Descriptor: 1,2-ETHANEDIOL, Fatty acid-binding protein, brain, ...
Authors:Yang, D, Liu, J, Zeng, H, Dong, A, Arrowsmith, C.H, Edwards, A.M, Peng, H, Halabelian, L, Structural Genomics Consortium (SGC)
Deposit date:2025-02-26
Release date:2025-05-21
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Co-crystal structure of FABP7 in complex with PFO3TDA
To be published
9NFK
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BU of 9nfk by Molmil
Tuna P-glycoprotein Apo Conformation 3
Descriptor: Permeability Glycoprotein (P-gp)
Authors:Young, M.A, Rees, S.D, Nicklisch, S.C.T, Stowell, M, Hamdoun, A, Chang, G.
Deposit date:2025-02-21
Release date:2025-06-04
Last modified:2025-06-18
Method:ELECTRON MICROSCOPY (3.99 Å)
Cite:Cryo-EM Structures of Apo and DDT-Bound P-Glycoprotein in Yellowfin Tuna.
Environ Sci Technol., 59, 2025
9NFL
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BU of 9nfl by Molmil
Tuna P-glycoprotein Apo Conformation 4
Descriptor: Permeability Glycoprotein (P-gp)
Authors:Young, M.A, Rees, S.D, Nicklisch, S.C.T, Stowell, M, Hamdoun, A, Chang, G.
Deposit date:2025-02-21
Release date:2025-06-04
Last modified:2025-06-18
Method:ELECTRON MICROSCOPY (4.02 Å)
Cite:Cryo-EM Structures of Apo and DDT-Bound P-Glycoprotein in Yellowfin Tuna.
Environ Sci Technol., 59, 2025
9P6P
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BU of 9p6p by Molmil
Crystal Structure of the SARS-CoV-2 2'-O-Methyltransferase with (m7GpppA)pUpU (Cap-0) and S-Adenosyl-L-homocysteine (SAH).
Descriptor: 2'-O-methyltransferase, 7N-METHYL-8-HYDROGUANOSINE-5'-TRIPHOSPHATE, CHLORIDE ION, ...
Authors:Minasov, G, Shuvalova, L, Maltseva, N, Kim, Y, Kiryukhina, O, Joachimiak, A, Satchell, K.J.F, Center for Structural Biology of Infectious Diseases (CSBID)
Deposit date:2025-06-19
Release date:2025-07-02
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Crystal Structure of the SARS-CoV-2 2'-O-Methyltransferase with (m7GpppA)pUpU (Cap-0) and S-Adenosyl-L-homocysteine (SAH).
To Be Published
9NWC
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BU of 9nwc by Molmil
Crystal structure of SARS-CoV-2 main protease in complex with an inhibitor TKB-276-5Br
Descriptor: (1R,2S,5S)-N-{(1S,2S)-1-(5-bromo-1,3-benzothiazol-2-yl)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-6,6-dimethyl-3-[3-methyl-N-(trifluoroacetyl)-D-valyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide, 3C-like proteinase nsp5
Authors:Bulut, H, Kuwata, N, Hayashi, H, Aoki, H, Hattori, S, Li, M, Das, D, Misumi, S, Wlodawer, A, Tamamura, H, Mitsuya, H.
Deposit date:2025-03-21
Release date:2025-06-04
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:Impact of Single Halogen Atom Substitutions on Potency of Inhibitors Targeting SARS-CoV-2 Main Protease
To Be Published
9LBN
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BU of 9lbn by Molmil
The composite cryo-EM structure of the head-to-tail connector and head-proximal tail components of bacteriophage phiXacJX1
Descriptor: adaptor protein gp5, portal protein gp1, stopper protein gp6, ...
Authors:Guo, M, Wang, A, Zheng, Y, Liu, C, Shao, Q, Fang, Q.
Deposit date:2025-01-03
Release date:2025-05-07
Last modified:2025-06-18
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:Cryo-EM structures of a Xanthomonas phage: Insights into viral architecture and implications for the model phage HK97.
Structure, 33, 2025
9NWD
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BU of 9nwd by Molmil
Human E3 ligase UBR4-KCMF1-calmodulin complex (N-terminal)
Descriptor: E3 ubiquitin-protein ligase UBR4
Authors:Yang, Z, Haakonsen, D.L, Heider, M, Witus, S.R, Zelter, A, Beschauner, T, MacCoss, M.J, Rape, M.
Deposit date:2025-03-22
Release date:2025-06-11
Method:ELECTRON MICROSCOPY (3.4 Å)
Cite:Molecular basis of SIFI activity in the integrated stress response.
Nature, 2025
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
Method:ELECTRON MICROSCOPY (3.4 Å)
Cite:Structure of a new capsid form and comparison with A-, B- and C-capsids clarify herpesvirus assembly
To Be Published
9NQT
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BU of 9nqt by Molmil
[3,5,11-2] Shifted DNA assembly with an aspect ratio of (3,5,11) base pairs and 2 nt sticky ends
Descriptor: DNA (5'-D(*GP*AP*GP*CP*CP*TP*G)-3'), DNA (5'-D(*TP*CP*TP*GP*TP*AP*GP*CP*TP*GP*TP*GP*TP*GP*GP*C)-3'), DNA (5'-D(P*AP*GP*GP*AP*CP*AP*CP*AP*GP*CP*TP*AP*CP*A)-3'), ...
Authors:Horvath, A, Vecchioni, S, Woloszyn, K, Ohayon, Y.P, Sha, R.
Deposit date:2025-03-13
Release date:2025-04-30
Method:X-RAY DIFFRACTION (6.09 Å)
Cite:Shifted tensegrity triangles
To Be Published
9Q9E
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BU of 9q9e by Molmil
Crystal structure of a TELSAM-SUMO1 fusion protein
Descriptor: PENTAETHYLENE GLYCOL, PHOSPHATE ION, Transcription factor ETV6,Small ubiquitin-related modifier 1
Authors:Coste, F, Mishra, A, Suskiewicz, M.J.
Deposit date:2025-02-26
Release date:2025-06-18
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Fusion Protein-Assisted Crystallization of Human SUMO1.
Proteins, 2025
9LVT
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BU of 9lvt by Molmil
Crystal structure of SARS-CoV-2 3CL protease in complex with compound 4
Descriptor: 1-(2-azanylideneethyl)-6-(1,3-dihydroisoindol-2-yl)-3-(5-methylpyridin-3-yl)-5-[[3,4,5-tris(fluoranyl)phenyl]methyl]pyrimidine-2,4-dione, 3C-like proteinase
Authors:Unoh, Y, Hirai, K, Uehara, S, Kawashima, S, Nobori, H, Sato, J, Shibayama, H, Hori, A, Nakahara, K, Kurahashi, K, Takamatsu, M, Yamamoto, S, Zhang, O, Tanimura, M, Dodo, R, Maruyama, Y, Sawa, H, Watari, R, Miyano, T, Kato, T, Sato, T, Tachibana, Y.
Deposit date:2025-02-12
Release date:2025-05-14
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Discovery of The Clinical Candidate S-892216: A Second-Generation of SARS-CoV-2 3CL Protease Inhibitor for Treating COVID-19
To Be Published
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:2025-06-04
Method:ELECTRON MICROSCOPY (4.2 Å)
Cite:Structure of a new capsid form and comparison with A-, B- and C-capsids clarify herpesvirus assembly
To Be Published, 2025
9O8B
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BU of 9o8b by Molmil
[5,8,6,P-2] Shifted tensegrity triangle with an (arm, center, arm) distribution of (5, 8, 6) base pairs, 2 nt sticky ends, and 5' phosphates
Descriptor: DNA (5'-D(P*AP*CP*GP*GP*AP*CP*AP*TP*CP*A)-3'), DNA (5'-D(P*CP*AP*CP*AP*CP*CP*GP*T)-3'), DNA (5'-D(P*GP*AP*GP*CP*AP*GP*CP*TP*GP*TP*G)-3'), ...
Authors:Abi Rizk, J, Vecchioni, S, Horvath, A, Woloszyn, K, Ohayon, Y.P, Sha, R.
Deposit date:2025-04-15
Release date:2025-05-28
Method:X-RAY DIFFRACTION (7.44 Å)
Cite:Shifted tensegrity triangles
To Be Published
9QI5
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BU of 9qi5 by Molmil
Crystal structure of I105R mutant of BlaC from Mycobacterium tuberculosis
Descriptor: Beta-lactamase, GLYCEROL, ZINC ION
Authors:Chikunova, A, Radojkovic, M, Ubbink, M.
Deposit date:2025-03-17
Release date:2025-06-11
Last modified:2025-07-09
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:A glycine at position 105 leads to clavulanic acid and avibactam resistance in class A beta-lactamases.
J.Biol.Chem., 2025
9OXQ
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BU of 9oxq by Molmil
X-ray crystal structure of Beta-Barrel forming peptide macrocycle
Descriptor: MC4H (ORN)FIH(SAR)H(ORN)WFHSH peptide macrocycle, MC4H (ORN)WFHSH(ORN)FIH(SAR)H peptide macrocycle, SULFATE ION
Authors:Dang, V.T, Nguyen, A.
Deposit date:2025-06-04
Release date:2025-06-18
Last modified:2025-07-09
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Beta-barrels From Short Peptide Macrocycles
To Be Published

238582

數據於2025-07-09公開中

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