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6ZR1
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BU of 6zr1 by Molmil
Racemic compound of RNA duplexes.
Descriptor: RNA (5'-R(*(0C)P*(0C)P*(0G)P*(0C)P*(0C)P*(0U)P*(0G)P*(0G))-3'), RNA (5'-R(*(0C)P*(0U)P*(0G)P*(0G)P*(0G)P*(0C)P*(0G)P*(0G))-3'), RNA (5'-R(*CP*CP*GP*CP*CP*UP*GP*G)-3'), ...
Authors:Rypniewski, W.
Deposit date:2020-07-10
Release date:2021-05-26
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.528 Å)
Cite:Broken symmetry between RNA enantiomers in a crystal lattice.
Nucleic Acids Res., 49, 2021
8DU5
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BU of 8du5 by Molmil
Murine sialidase-1 (NEU1)
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, Sialidase-1, ...
Authors:Gorelik, A, Illes, K, Nagar, B.
Deposit date:2022-07-26
Release date:2023-05-31
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (3.5 Å)
Cite:Structure of the immunoregulatory sialidase NEU1.
Sci Adv, 9, 2023
6PCO
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BU of 6pco by Molmil
Mechanism for regulation of DNA binding of Bordetella bronchiseptica BpsR by 6-hydroxynicotinic acid
Descriptor: 1,4-BUTANEDIOL, MarR-family transcriptional regulator
Authors:Booth, W.T, Davis, R.R, Deora, R, Hollis, T.
Deposit date:2019-06-17
Release date:2019-11-06
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.75 Å)
Cite:Structural mechanism for regulation of DNA binding of BpsR, a Bordetella regulator of biofilm formation, by 6-hydroxynicotinic acid.
Plos One, 14, 2019
6MDM
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BU of 6mdm by Molmil
The 20S supercomplex engaging the SNAP-25 N-terminus (class 1)
Descriptor: ADENOSINE-5'-DIPHOSPHATE, ADENOSINE-5'-TRIPHOSPHATE, Alpha-soluble NSF attachment protein, ...
Authors:White, K.I, Zhao, M, Brunger, A.T.
Deposit date:2018-09-04
Release date:2018-09-19
Last modified:2024-03-13
Method:ELECTRON MICROSCOPY (4.4 Å)
Cite:Structural principles of SNARE complex recognition by the AAA+ protein NSF.
Elife, 7, 2018
6TXK
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BU of 6txk by Molmil
Crystal structure of thermotoga maritima E65K Ferritin
Descriptor: EICOSANE, FE (III) ION, Ferritin, ...
Authors:Wilk, P, Grudnik, P, Kumar, M, Heddle, J, Chakraborti, S.
Deposit date:2020-01-14
Release date:2021-07-28
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.359 Å)
Cite:A single residue can modulate nanocage assembly in salt dependent ferritin.
Nanoscale, 13, 2021
7M76
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BU of 7m76 by Molmil
Room Temperature XFEL Crystallography reveals asymmetry in the vicinity of the two phylloquinones in Photosystem I
Descriptor: 1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLE, 1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDE, BETA-CAROTENE, ...
Authors:Keable, S.M, Simon, P.S, Kolsch, A, Kern, J, Yachandra, V.K, Zouni, A, Yano, J.
Deposit date:2021-03-26
Release date:2021-11-24
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (3 Å)
Cite:Room temperature XFEL crystallography reveals asymmetry in the vicinity of the two phylloquinones in photosystem I.
Sci Rep, 11, 2021
6ZX5
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BU of 6zx5 by Molmil
Racemic compound of RNA duplexes.
Descriptor: RNA (5'-R(*(0C)P*(0C)P*(0G)P*(0C)P*(0C)P*(0U)P*(0G)P*(0G))-3'), RNA (5'-R(*(0C)P*(0U)P*(0G)P*(0G)P*(0G)P*(0C)P*(0G)P*(0G))-3'), RNA (5'-R(*CP*CP*GP*CP*CP*UP*GP*G)-3'), ...
Authors:Rypniewski, W.
Deposit date:2020-07-29
Release date:2021-05-26
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.523 Å)
Cite:Broken symmetry between RNA enantiomers in a crystal lattice.
Nucleic Acids Res., 49, 2021
8DKK
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BU of 8dkk by Molmil
Polymorphism in SARS-CoV-2 Nsp5 main protease reveals differences in cleavage of viral and host substrates
Descriptor: 3C-like proteinase nsp5
Authors:Lu, J, Khan, M.B, Young, H.S, Lemieux, M.J.
Deposit date:2022-07-05
Release date:2023-05-03
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (2 Å)
Cite:SARS-CoV-2 M pro Protease Variants of Concern Display Altered Viral Substrate and Cell Host Target Galectin-8 Processing but Retain Sensitivity toward Antivirals.
Acs Cent.Sci., 9, 2023
6TXI
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BU of 6txi by Molmil
Crystal structure of thermotoga maritima E65A Ferritin
Descriptor: EICOSANE, FE (III) ION, Ferritin, ...
Authors:Wilk, P, Grudnik, P, Kumar, M, Heddle, J, Chakraborti, S.
Deposit date:2020-01-14
Release date:2021-07-28
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.759 Å)
Cite:A single residue can modulate nanocage assembly in salt dependent ferritin.
Nanoscale, 13, 2021
7M3T
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BU of 7m3t by Molmil
Crystallographic structure of a cubic crystal of STMV (80.7 degree rotation about 111) grown from chloride
Descriptor: CHLORIDE ION, Coat protein, MAGNESIUM ION, ...
Authors:McPherson, A.
Deposit date:2021-03-19
Release date:2021-12-15
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:Structures of additional crystal forms of Satellite tobacco mosaic virus grown from a variety of salts.
Acta Crystallogr.,Sect.F, 77, 2021
6PCW
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BU of 6pcw by Molmil
Human PIM1 bound to benzothiophene inhibitor 213
Descriptor: 4-[5-(cyclopropylcarbamoyl)thiophen-2-yl]-1-benzothiophene-2-carboxamide, GLYCEROL, Peptide, ...
Authors:Godoi, P.H.C, Santiago, A.S, Fala, A.M, Ramos, P.Z, Sriranganadane, D, Mascarello, A, Segretti, N, Azevedo, H, Guimaraes, C.R.W, Arruda, P, Elkins, J.M, Counago, R.M, Structural Genomics Consortium (SGC)
Deposit date:2019-06-18
Release date:2019-07-24
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:PIM1 bound to benzothiophene inhibitor
To Be Published
6MA4
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BU of 6ma4 by Molmil
Crystal structure of human O-GlcNAc transferase bound to a peptide from HCF-1 pro-repeat 2 (11-26) and inhibitor 3a
Descriptor: 5-{2-[(1R)-2-{(carboxymethyl)[(thiophen-2-yl)methyl]amino}-2-oxo-1-{[(2-oxo-1,2-dihydroquinolin-6-yl)sulfonyl]amino}ethyl]phenoxy}pentanoic acid, Host Cell Factor 1 peptide, UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit
Authors:Martin, S.E.S, Lazarus, M.B, Walker, S.
Deposit date:2018-08-25
Release date:2018-10-17
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structure-Based Evolution of Low Nanomolar O-GlcNAc Transferase Inhibitors.
J. Am. Chem. Soc., 140, 2018
7A0N
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BU of 7a0n by Molmil
Structure of TSC1 NTD and linker domain
Descriptor: Uncharacterized protein,Uncharacterized protein
Authors:Fitzian, K, Kuemmel, D.
Deposit date:2020-08-10
Release date:2021-05-26
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (4.3 Å)
Cite:TSC1 binding to lysosomal PIPs is required for TSC complex translocation and mTORC1 regulation.
Mol.Cell, 81, 2021
8E5S
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BU of 8e5s by Molmil
X-ray structure of the Deinococcus radiodurans Nramp/MntH divalent transition metal transporter WT in an occluded state
Descriptor: (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Ray, S, Gaudet, R.
Deposit date:2022-08-22
Release date:2023-05-03
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.38 Å)
Cite:High-resolution structures with bound Mn 2+ and Cd 2+ map the metal import pathway in an Nramp transporter.
Elife, 12, 2023
6U46
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BU of 6u46 by Molmil
Solution Structure of a Heat-Resistant Long-Acting Insulin Analog
Descriptor: Insulin
Authors:Yang, Y, Weiss, M.A.
Deposit date:2019-08-23
Release date:2020-08-26
Last modified:2024-10-23
Method:SOLUTION NMR
Cite:Solution Structure of a Heat-Resistant Long-Acting Insulin Analog
To Be Published
6ZRL
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BU of 6zrl by Molmil
Racemic compound of RNA duplexes.
Descriptor: RNA (5'-R(*(0C)P*(0C)P*(0G)P*(0C)P*(0C)P*(0U)P*(0G)P*(0G))-3'), RNA (5'-R(*(0C)P*(0U)P*(0G)P*(0G)P*(0G)P*(0C)P*(0G)P*(0G))-3'), RNA (5'-R(*CP*CP*GP*CP*CP*UP*GP*G)-3'), ...
Authors:Rypniewski, W.
Deposit date:2020-07-13
Release date:2021-05-26
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.53 Å)
Cite:Broken symmetry between RNA enantiomers in a crystal lattice.
Nucleic Acids Res., 49, 2021
6MAQ
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BU of 6maq by Molmil
F9 Pilus Adhesin FmlH Lectin Domain from E. coli UTI89 in Complex with Galactoside 2'-{[(2S,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5-nitro-[1,1'-biphenyl]-3-carboxylic acid
Descriptor: 2'-{[2-(acetylamino)-2-deoxy-beta-D-galactopyranosyl]oxy}-5-nitro[1,1'-biphenyl]-3-carboxylic acid, Fimbrial adhesin FmlD, GLYCEROL
Authors:Klein, R.D, Hultgren, S.J.
Deposit date:2018-08-28
Release date:2019-09-04
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.31 Å)
Cite:Biphenyl Gal and GalNAc FmlH Lectin Antagonists of Uropathogenic E. coli (UPEC): Optimization through Iterative Rational Drug Design.
J.Med.Chem., 62, 2019
6PCZ
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BU of 6pcz by Molmil
Crystal structure of the bacterial cellulose synthase subunit G (BcsG) catalytic domain from Escherichia coli, selenomethionine variant
Descriptor: Cellulose biosynthesis protein BcsG, MAGNESIUM ION, ZINC ION
Authors:Anderson, A.C, Brenner, T, Weadge, J.T.
Deposit date:2019-06-18
Release date:2020-03-18
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1.44 Å)
Cite:TheEscherichia colicellulose synthase subunit G (BcsG) is a Zn2+-dependent phosphoethanolamine transferase.
J.Biol.Chem., 295, 2020
7M54
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BU of 7m54 by Molmil
Crystallographic structure of a cubic crystal form of STMV grown from bromide
Descriptor: BROMIDE ION, CALCIUM ION, CHLORIDE ION, ...
Authors:McPherson, A.
Deposit date:2021-03-22
Release date:2021-12-15
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (3.8 Å)
Cite:Structures of additional crystal forms of Satellite tobacco mosaic virus grown from a variety of salts.
Acta Crystallogr.,Sect.F, 77, 2021
6PPN
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BU of 6ppn by Molmil
Structure of S. pombe Lsm2-8 with unprocessed U6 snRNA
Descriptor: Mimic of unprocessed U6 snRNA, Probable U6 snRNA-associated Sm-like protein LSm3, Probable U6 snRNA-associated Sm-like protein LSm4, ...
Authors:Montemayor, E.J, Butcher, S.E.
Deposit date:2019-07-08
Release date:2020-06-17
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.91 Å)
Cite:Molecular basis for the distinct cellular functions of the Lsm1-7 and Lsm2-8 complexes.
Rna, 26, 2020
7M50
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BU of 7m50 by Molmil
Crystallographic structure of a cubic crystal form of STMV grown from ammonium sulfate
Descriptor: CHLORIDE ION, Coat protein, MAGNESIUM ION, ...
Authors:McPherson, A.
Deposit date:2021-03-22
Release date:2021-12-15
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.31 Å)
Cite:Structures of additional crystal forms of Satellite tobacco mosaic virus grown from a variety of salts.
Acta Crystallogr.,Sect.F, 77, 2021
8E7A
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BU of 8e7a by Molmil
Crystal structure of the p53 (Y107H) core domain orthorhombic P form
Descriptor: Cellular tumor antigen p53, ZINC ION
Authors:Lovell, S, Liu, L, Battaile, K.P, Miller, S, Karanicolas, J.
Deposit date:2022-08-23
Release date:2023-05-17
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:An African-Specific Variant of TP53 Reveals PADI4 as a Regulator of p53-Mediated Tumor Suppression.
Cancer Discov, 13, 2023
6UCO
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BU of 6uco by Molmil
Backbone-modified variant of zinc finger 2 from the transcription factor Sp1 DNA binding domain: BTD in the metal-binding turn
Descriptor: Transcription factor Sp1, ZINC ION
Authors:Rao, S.R, Horne, W.S.
Deposit date:2019-09-17
Release date:2020-06-24
Last modified:2024-10-16
Method:SOLUTION NMR
Cite:Proteomimetic Zinc Finger Domains with Modified Metal-binding beta-Turns.
Pept Sci (Hoboken), 112, 2020
6MAY
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BU of 6may by Molmil
Crystal structure of N-myristoyl transferase (NMT) G386E mutant from Plasmodium vivax
Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, Glycylpeptide N-tetradecanoyltransferase, ...
Authors:Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:2018-08-29
Release date:2019-06-05
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Structure-Guided Identification of Resistance Breaking Antimalarial N‐Myristoyltransferase Inhibitors.
Cell Chem Biol, 26, 2019
6ZY5
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BU of 6zy5 by Molmil
Cryo-EM structure of the Human topoisomerase II alpha DNA-binding/cleavage domain in State 1
Descriptor: (5S,5aR,8aR,9R)-9-(4-hydroxy-3,5-dimethoxyphenyl)-8-oxo-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol -5-yl 4,6-O-[(1R)-ethylidene]-beta-D-glucopyranoside, DNA (5'-D(*CP*GP*CP*GP*CP*AP*TP*CP*GP*TP*CP*AP*TP*CP*CP*TP*C)-3'), DNA (5'-D(*GP*AP*GP*GP*AP*TP*GP*AP*CP*GP*AP*TP*G)-3'), ...
Authors:Vanden Broeck, A, Lamour, V.
Deposit date:2020-07-30
Release date:2021-05-26
Last modified:2024-05-01
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:Structural basis for allosteric regulation of Human Topoisomerase II alpha.
Nat Commun, 12, 2021

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