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6PLA
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BU of 6pla by Molmil
Adducts formed after 1 month in the reaction of dichlorido(1,3-dimethylbenzimidazol-2-ylidene)(eta6-p-cymene)osmium(II) with HEWL
Descriptor: Lysozyme, OSMIUM ION, SODIUM ION, ...
Authors:Sullivan, M.P, Hartinger, C.G, Goldstone, D.C.
Deposit date:2019-06-30
Release date:2020-11-25
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Probing the Paradigm of Promiscuity for N-Heterocyclic Carbene Complexes and their Protein Adduct Formation.
Angew.Chem.Int.Ed.Engl., 2021
8PU0
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BU of 8pu0 by Molmil
Cryo-EM structure of human Elp123 in complex with tRNA, desulpho-CoA, 5'-deoxyadenosine and methionine
Descriptor: 5'-DEOXYADENOSINE, DESULFO-COENZYME A, Elongator complex protein 1, ...
Authors:Abbassi, N, Jaciuk, M, Lin, T.-Y, Glatt, S.
Deposit date:2023-07-16
Release date:2024-04-17
Last modified:2024-05-22
Method:ELECTRON MICROSCOPY (4.25 Å)
Cite:Cryo-EM structures of the human Elongator complex at work.
Nat Commun, 15, 2024
6PPK
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BU of 6ppk by Molmil
RbgA+45SRbgA complex
Descriptor: 23S rRNA, 50S ribosomal protein L13, 50S ribosomal protein L14, ...
Authors:Ortega, J.
Deposit date:2019-07-07
Release date:2019-09-18
Last modified:2024-03-20
Method:ELECTRON MICROSCOPY (4.4 Å)
Cite:Structural consequences of the interaction of RbgA with a 50S ribosomal subunit assembly intermediate.
Nucleic Acids Res., 47, 2019
8PTZ
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BU of 8ptz by Molmil
Cryo-EM structure of human Elp123 in complex with tRNA, S-ethyl-CoA, 5'-deoxyadenosine and methionine
Descriptor: 5'-DEOXYADENOSINE, Elongator complex protein 1, Elongator complex protein 2, ...
Authors:Abbassi, N, Jaciuk, M, Lin, T.-Y, Glatt, S.
Deposit date:2023-07-16
Release date:2024-04-17
Last modified:2024-05-22
Method:ELECTRON MICROSCOPY (3.35 Å)
Cite:Cryo-EM structures of the human Elongator complex at work.
Nat Commun, 15, 2024
8PTY
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BU of 8pty by Molmil
Cryo-EM structure of human Elp123 in complex with 5'-deoxyadenosine and methionine
Descriptor: 5'-DEOXYADENOSINE, Elongator complex protein 1, Elongator complex protein 2, ...
Authors:Abbassi, N, Jaciuk, M, Lin, T.-Y, Glatt, S.
Deposit date:2023-07-16
Release date:2024-04-17
Last modified:2024-05-22
Method:ELECTRON MICROSCOPY (3.58 Å)
Cite:Cryo-EM structures of the human Elongator complex at work.
Nat Commun, 15, 2024
6PNU
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BU of 6pnu by Molmil
Crystal structure of native DauA
Descriptor: 1,2-ETHANEDIOL, Aldehyde dehydrogenase
Authors:Pluvinage, B, Boraston, A.B.
Deposit date:2019-07-03
Release date:2019-10-02
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2 Å)
Cite:Insights into the kappa / iota-carrageenan metabolism pathway of some marinePseudoalteromonasspecies.
Commun Biol, 2, 2019
8PPR
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BU of 8ppr by Molmil
Structure of the human outer kinetochore KMN network complex
Descriptor: Kinetochore protein Spc24, Kinetochore protein Spc25, Kinetochore scaffold 1, ...
Authors:Yatskevich, S, Barford, D.
Deposit date:2023-07-08
Release date:2024-03-20
Last modified:2024-07-03
Method:ELECTRON MICROSCOPY (3 Å)
Cite:Structure of the human outer kinetochore KMN network complex.
Nat.Struct.Mol.Biol., 31, 2024
6PAY
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BU of 6pay by Molmil
Structure of HsICDH1:Mg(II):ICT:NADPH(50%) complex reveals structural basis for observation of half-sites reactivity
Descriptor: FORMIC ACID, ISOCITRIC ACID, Isocitrate dehydrogenase [NADP] cytoplasmic, ...
Authors:Silvaggi, N.R, Melkonian, T.R, Roman, J.V, Moran, G.R.
Deposit date:2019-06-12
Release date:2019-09-18
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.199 Å)
Cite:Transient-State Analysis of Human Isocitrate Dehydrogenase I: Accounting for the Interconversion of Active and Non-Active Conformational States.
Biochemistry, 58, 2019
6WME
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BU of 6wme by Molmil
Human Sun2-KASH3 complex
Descriptor: Nesprin-3, POTASSIUM ION, SUN domain-containing protein 2
Authors:Cruz, V.E, Schwartz, T.U.
Deposit date:2020-04-21
Release date:2020-12-02
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.53 Å)
Cite:Structural Analysis of Different LINC Complexes Reveals Distinct Binding Modes.
J.Mol.Biol., 432, 2020
6PQ6
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BU of 6pq6 by Molmil
The crystal structure of 3-methoxybenzoate-bound CYP199A4
Descriptor: 3-methoxybenzoic acid, CHLORIDE ION, Cytochrome P450, ...
Authors:Podgorski, M.N, Bell, S.G, Bruning, J.B.
Deposit date:2019-07-08
Release date:2019-11-27
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.658 Å)
Cite:Investigation of the requirements for efficient and selective cytochrome P450 monooxygenase catalysis across different reactions.
J.Inorg.Biochem., 203, 2019
6PQS
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BU of 6pqs by Molmil
The crystal structure of 4-methylbenzoate-bound CYP199A4
Descriptor: 4-METHYLBENZOIC ACID, CHLORIDE ION, Cytochrome P450, ...
Authors:Podgorski, M.N, Bruning, J.B, Bell, S.G.
Deposit date:2019-07-10
Release date:2019-11-27
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Investigation of the requirements for efficient and selective cytochrome P450 monooxygenase catalysis across different reactions.
J.Inorg.Biochem., 203, 2019
6PD6
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BU of 6pd6 by Molmil
Crystal Structure of a H5N1 influenza virus hemagglutinin at pH 7.0
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, GLYCEROL, Hemagglutinin, ...
Authors:Antanasijevic, A, Durst, M.A, Lavie, A, Caffrey, M.
Deposit date:2019-06-18
Release date:2019-11-13
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.87 Å)
Cite:Identification of a pH sensor in Influenza hemagglutinin using X-ray crystallography.
J.Struct.Biol., 209, 2020
6PRS
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BU of 6prs by Molmil
The crystal structure of 3-ethoxybenzoate-bound CYP199A4
Descriptor: 3-ethoxybenzoic acid, CHLORIDE ION, Cytochrome P450, ...
Authors:Podgorski, M.N, Bruning, J.B, Bell, S.G.
Deposit date:2019-07-11
Release date:2019-11-27
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.373 Å)
Cite:Investigation of the requirements for efficient and selective cytochrome P450 monooxygenase catalysis across different reactions.
J.Inorg.Biochem., 203, 2019
6PS0
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BU of 6ps0 by Molmil
XFEL beta2 AR structure by ligand exchange from Alprenolol to Carazolol.
Descriptor: (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, (2S)-1-(9H-Carbazol-4-yloxy)-3-(isopropylamino)propan-2-ol, CHOLESTEROL, ...
Authors:Ishchenko, A, Stauch, B, Han, G.W, Batyuk, A, Shiriaeva, A, Li, C, Zatsepin, N.A, Weierstall, U, Liu, W, Nango, E, Nakane, T, Tanaka, R, Tono, K, Joti, Y, Iwata, S, Moraes, I, Gati, C, Cherezov, C.
Deposit date:2019-07-12
Release date:2019-11-13
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (3.4 Å)
Cite:Toward G protein-coupled receptor structure-based drug design using X-ray lasers.
Iucrj, 6, 2019
6WM2
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BU of 6wm2 by Molmil
Human V-ATPase in state 1 with SidK and ADP
Descriptor: (2~{S})-2-$l^{4}-azanyl-3-[[(2~{R})-3-octadecanoyloxy-2-oxidanyl-propoxy]-oxidanyl-oxidanylidene-$l^{6}-phosphanyl]oxy-propanoic acid, 1,2-DICAPROYL-SN-PHOSPHATIDYL-L-SERINE, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Wang, L, Wu, H, Fu, T.M.
Deposit date:2020-04-20
Release date:2020-11-11
Last modified:2020-11-25
Method:ELECTRON MICROSCOPY (3.1 Å)
Cite:Structures of a Complete Human V-ATPase Reveal Mechanisms of Its Assembly.
Mol.Cell, 80, 2020
6PH0
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BU of 6ph0 by Molmil
T4 lysozyme pseudo-wild type soaked in TEMPO
Descriptor: 2-HYDROXYETHYL DISULFIDE, CHLORIDE ION, Endolysin
Authors:Cuneo, M.J, Myles, D.A, Li, L.
Deposit date:2019-06-25
Release date:2020-07-01
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.947 Å)
Cite:Making hydrogens stand out: Enhanced neutron diffraction from biological crystals using dynamic nuclear polarization
To be published
6PCM
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BU of 6pcm by Molmil
Crystal Structure of Mycobacterium smegmatis Topoisomerase I with ssDNA bound to both N- and C-terminal domains
Descriptor: DNA (5'-D(P*AP*GP*TP*GP*AP*GP*CP*GP*AP*GP*CP*TP*TP*CP*CP*GP*CP*TP*TP*GP*AP*CP*TP*T)-3'), DNA topoisomerase 1, SULFATE ION
Authors:Tan, K, Cao, N, Tse-Dinh, Y.C.
Deposit date:2019-06-17
Release date:2020-03-25
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (3.107 Å)
Cite:Mechanistic insights from structure of Mycobacterium smegmatis topoisomerase I with ssDNA bound to both N- and C-terminal domains.
Nucleic Acids Res., 48, 2020
6PD5
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BU of 6pd5 by Molmil
Crystal Structure of a H5N1 influenza virus hemagglutinin at pH 6.5
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, GLYCEROL, Hemagglutinin, ...
Authors:Antanasijevic, A, Durst, M.A, Lavie, A, Caffrey, M.
Deposit date:2019-06-18
Release date:2019-11-13
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.39 Å)
Cite:Identification of a pH sensor in Influenza hemagglutinin using X-ray crystallography.
J.Struct.Biol., 209, 2020
6PI0
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BU of 6pi0 by Molmil
AgaD472N-Linear Blood group B type 2 trisaccharide complex structure
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, Alpha-galactosidase, ...
Authors:Pluvinage, B, Boraston, A.B.
Deposit date:2019-06-25
Release date:2019-10-02
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:Molecular analysis of an enigmaticStreptococcus pneumoniaevirulence factor: The raffinose-family oligosaccharide utilization system.
J.Biol.Chem., 294, 2019
6PLB
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BU of 6plb by Molmil
Adducts formed after 1 month in the reaction of dichlorido(1,3-dimethylbenzimida zol-2-ylidene)(eta5-pentamethylcyclopentadienyl)iridium(III) with HEWL
Descriptor: 2-(1-chloranyl-2,3,4,5,6-pentamethyl-1$l^{7}-iridapentacyclo[2.2.0.0^{1,3}.0^{1,5}.0^{2,6}]hexan-1-yl)-1,3-dimethyl-benzimidazole, Lysozyme, SODIUM ION
Authors:Sullivan, M.P, Hartinger, C.G, Goldstone, D.C.
Deposit date:2019-06-30
Release date:2020-11-25
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Probing the Paradigm of Promiscuity for N-Heterocyclic Carbene Complexes and their Protein Adduct Formation.
Angew.Chem.Int.Ed.Engl., 2021
6YQM
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BU of 6yqm by Molmil
Human histidine triad nucleotide-binding protein 1 (hHINT1) complexed with dGMP and refined to 1.02 A
Descriptor: 2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE, DI(HYDROXYETHYL)ETHER, Histidine triad nucleotide-binding protein 1
Authors:Dolot, R.D, Seda, A, Nawrot, B.C.
Deposit date:2020-04-17
Release date:2020-04-29
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.02 Å)
Cite:Biochemical, crystallographic and biophysical characterization of histidine triad nucleotide-binding protein 2 with different ligands including a non-hydrolyzable analog of Ap4A.
Biochim Biophys Acta Gen Subj, 1865, 2021
6PGY
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BU of 6pgy by Molmil
MTSL labelled T4 lysozyme pseudo-wild type K65C mutant
Descriptor: 2-HYDROXYETHYL DISULFIDE, CHLORIDE ION, Endolysin, ...
Authors:Cuneo, M.J, Myles, D.A, Li, L.
Deposit date:2019-06-25
Release date:2020-07-01
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2 Å)
Cite:Making hydrogens stand out: Enhanced neutron diffraction from biological crystals using dynamic nuclear polarization
To be published
6PHU
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BU of 6phu by Molmil
SpAga wild type apo structure
Descriptor: 1,2-ETHANEDIOL, Alpha-galactosidase, L(+)-TARTARIC ACID
Authors:Pluvinage, B, Boraston, A.B.
Deposit date:2019-06-25
Release date:2019-10-02
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Molecular analysis of an enigmaticStreptococcus pneumoniaevirulence factor: The raffinose-family oligosaccharide utilization system.
J.Biol.Chem., 294, 2019
6YCS
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BU of 6ycs by Molmil
Human Transcription Cofactor PC4 DNA-binding domain in complex with full phosphorothioate 5-10-5 2'-O-methyl DNA gapmer antisense oligonucleotide.
Descriptor: DNA (5'-D(P*(OKQ))-D(P*(OKT))-R(P*(RFJ))-D(*(OKQ)P*(OKT)P*(AS)P*(GS)P*(OKN)P*(OKN)P*(PST)P*(OKN)P*(PST)P*(GS)P*(GS)P*(AS)P*(OKT)P*(OKT))-3'), PC4 protein, SODIUM ION, ...
Authors:Hyjek-Skladanowska, M, Vickers, T.A, Napiorkowska, A, Anderson, B, Tanowitz, M, Crooke, S.T, Liang, X, Seth, P.P, Nowotny, M.
Deposit date:2020-03-19
Release date:2020-04-29
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (3.05 Å)
Cite:Origins of the Increased Affinity of Phosphorothioate-Modified Therapeutic Nucleic Acids for Proteins.
J.Am.Chem.Soc., 142, 2020
6PA1
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BU of 6pa1 by Molmil
Killer cell immunoglobulin-like receptor 2DL2 in complex with HLA-C*07:02
Descriptor: ARG-TYR-ARG-PRO-GLY-THR-VAL-ALA-LEU, Beta-2-microglobulin, HLA class I histocompatibility antigen, ...
Authors:Moradi, S, Rossjohn, J, Vivian, J.P.
Deposit date:2019-06-11
Release date:2020-12-16
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (3.01 Å)
Cite:Structural plasticity of KIR2DL2 and KIR2DL3 enables altered docking geometries atop HLA-C.
Nat Commun, 12, 2021

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