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8AD7
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BU of 8ad7 by Molmil
Flavin-dependent tryptophan 6-halogenase Thal in complex with D-Trp
Descriptor: D-TRYPTOPHAN, GLYCEROL, PHOSPHATE ION, ...
Authors:Moritzer, A.C, Niemann, H.H.
Deposit date:2022-07-08
Release date:2022-10-12
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.33 Å)
Cite:Enzymatic Late-Stage Halogenation of Peptides.
Chembiochem, 24, 2023
8AD0
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BU of 8ad0 by Molmil
X-ray structure of Na+-NQR from Vibrio cholerae in different conformation at 3.1 A
Descriptor: 1,2-Distearoyl-sn-glycerophosphoethanolamine, BROMIDE ION, DODECYL-BETA-D-MALTOSIDE, ...
Authors:Fritz, G.
Deposit date:2022-07-07
Release date:2023-07-12
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (3.11 Å)
Cite:X-ray structure of Na+-NQR from Vibrio cholerae at 3.4 A resolution
Nat.Struct.Mol.Biol., 2023
8ACY
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BU of 8acy by Molmil
X-ray structure of Na+-NQR from Vibrio cholerae at 3.5 A resolution
Descriptor: DODECYL-BETA-D-MALTOSIDE, FE2/S2 (INORGANIC) CLUSTER, FLAVIN MONONUCLEOTIDE, ...
Authors:Fritz, G.
Deposit date:2022-07-07
Release date:2023-07-12
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (3.5 Å)
Cite:Conformational coupling of redox-driven Na + -translocation in Vibrio cholerae NADH:quinone oxidoreductase.
Nat.Struct.Mol.Biol., 30, 2023
8ACW
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BU of 8acw by Molmil
X-ray structure of Na+-NQR from Vibrio cholerae at 3.4 A resolution
Descriptor: DODECYL-BETA-D-MALTOSIDE, FE2/S2 (INORGANIC) CLUSTER, FLAVIN MONONUCLEOTIDE, ...
Authors:Fritz, G.
Deposit date:2022-07-07
Release date:2023-07-12
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (3.4 Å)
Cite:Conformational coupling of redox-driven Na + -translocation in Vibrio cholerae NADH:quinone oxidoreductase.
Nat.Struct.Mol.Biol., 30, 2023
8ACV
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BU of 8acv by Molmil
WelO5* bound to Zn(II), Cl, and 2-oxoglutarate
Descriptor: 2-OXOGLUTARIC ACID, ACETATE ION, CHLORIDE ION, ...
Authors:Buller, R, Hueppi, S, Voss, M, Hayashi, T.
Deposit date:2022-07-07
Release date:2022-11-02
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.26 Å)
Cite:Enzyme engineering enables inversion of substrate stereopreference of the halogenase WelO5*
Chemcatchem, 2022
8ACS
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BU of 8acs by Molmil
Crystal structure of FMO from Janthinobacterium svalbardensis
Descriptor: DI(HYDROXYETHYL)ETHER, FAD-dependent oxidoreductase, FLAVIN-ADENINE DINUCLEOTIDE, ...
Authors:Polidori, N, Galuska, P, Gruber, K.
Deposit date:2022-07-06
Release date:2022-09-07
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:A Cold-Active Flavin-Dependent Monooxygenase from Janthinobacterium svalbardensis Unlocks Applications of Baeyer-Villiger Monooxygenases at Low Temperature.
Acs Catalysis, 13, 2023
8ACQ
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BU of 8acq by Molmil
S-layer Deinoxanthin-Binding Complex (SDBC), subunit DR_2577 assembled with its SOD DR_0644
Descriptor: (3~{S},5~{R},6~{R})-5-[(3~{S},7~{R},12~{S},16~{S},20~{S})-3,7,12,16,20,24-hexamethyl-24-oxidanyl-pentacosyl]-4,4,6-trimethyl-cyclohexane-1,3-diol, COPPER (II) ION, DR_0644, ...
Authors:Farci, D, Piano, D.
Deposit date:2022-07-06
Release date:2023-04-12
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (2.54 Å)
Cite:The SDBC is active in quenching oxidative conditions and bridges the cell envelope layers in Deinococcus radiodurans.
J.Biol.Chem., 299, 2023
8ACO
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BU of 8aco by Molmil
Crystal structure of WT p38alpha
Descriptor: 4-[5-(4-FLUORO-PHENYL)-2-(4-METHANESULFINYL-PHENYL)-3H-IMIDAZOL-4-YL]-PYRIDINE, MAGNESIUM ION, Mitogen-activated protein kinase 14
Authors:Pous, J, Baginski, B, Gonzalez, L, Macias, M.J, Nebreda, A.R.
Deposit date:2022-07-05
Release date:2023-11-29
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Crystal structure of WT p38alpha
Res Sq
8ACM
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BU of 8acm by Molmil
Crystal structure of WT p38alpha
Descriptor: 4-[5-(4-FLUORO-PHENYL)-2-(4-METHANESULFINYL-PHENYL)-3H-IMIDAZOL-4-YL]-PYRIDINE, MAGNESIUM ION, Mitogen-activated protein kinase 14
Authors:Pous, J, Baginski, B, Gonzalez, L, Macias, M.J, Nebreda, A.R.
Deposit date:2022-07-05
Release date:2023-11-29
Method:X-RAY DIFFRACTION (2.14 Å)
Cite:Crystal structure of WT p38alpha
Res Sq
8ACL
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BU of 8acl by Molmil
Crystal structure of SARS-CoV-2 main protease (MPro) in complex with the non-covalent inhibitor GC-14
Descriptor: (2~{S})-1-(3,4-dichlorophenyl)-4-pyridin-3-ylcarbonyl-~{N}-(thiophen-2-ylmethyl)piperazine-2-carboxamide, 3C-like proteinase nsp5
Authors:Strater, N, Muller, C, Sylvester, K, Claff, T, Weisse, R.H, Gao, S, Tollefson, A.E, Liu, X, Zhan, P.
Deposit date:2022-07-05
Release date:2022-09-28
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Discovery and Crystallographic Studies of Trisubstituted Piperazine Derivatives as Non-Covalent SARS-CoV-2 Main Protease Inhibitors with High Target Specificity and Low Toxicity.
J.Med.Chem., 65, 2022
8ACK
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BU of 8ack by Molmil
Structure of Pseudomonas aeruginosa aminopeptidase, PaAP
Descriptor: CACODYLATE ION, Keratinase KP1, PCP, ...
Authors:Harding, C.J, Czekster, C.M.
Deposit date:2022-07-05
Release date:2023-07-12
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.784 Å)
Cite:An anti-biofilm cyclic peptide targets a secreted aminopeptidase from P. aeruginosa.
Nat.Chem.Biol., 19, 2023
8ACH
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BU of 8ach by Molmil
Nudaurelia capensis omega virus maturation intermediate captured at pH5.6 (insect cell expressed VLPs): large class from symmetry expansion
Descriptor: p70
Authors:Castells-Graells, R, Hesketh, E.L, Johnson, J.E, Ranson, N.A, Lawson, D.M, Lomonossoff, G.P.
Deposit date:2022-07-05
Release date:2022-12-28
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (3.91 Å)
Cite:Decoding virus maturation with cryo-EM structures of intermediates
To be published
8ACD
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BU of 8acd by Molmil
Crystal structure of SARS-CoV-2 main protease (MPro) in complex with the non-covalent inhibitor GA-17S
Descriptor: (2~{S})-4-[[2,4-bis(oxidanylidene)-1~{H}-pyrimidin-6-yl]carbonyl]-1-(3,4-dichlorophenyl)-~{N}-(thiophen-2-ylmethyl)piperazine-2-carboxamide, 3C-like proteinase nsp5
Authors:Strater, N, Muller, C.E, Sylvester, K, Claff, T, Weisse, R.H, Gao, S, Tollefson, A.E, Liu, X, Zhan, P.
Deposit date:2022-07-05
Release date:2022-09-28
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.39 Å)
Cite:Discovery and Crystallographic Studies of Trisubstituted Piperazine Derivatives as Non-Covalent SARS-CoV-2 Main Protease Inhibitors with High Target Specificity and Low Toxicity.
J.Med.Chem., 65, 2022
8AC7
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BU of 8ac7 by Molmil
Structure of Pseudomonas aeruginosa aminopeptidase, PaAP
Descriptor: ACETATE ION, ISOPROPYL ALCOHOL, Keratinase KP1, ...
Authors:Harding, C.J, Czekster, C.M.
Deposit date:2022-07-05
Release date:2023-07-12
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:An anti-biofilm cyclic peptide targets a secreted aminopeptidase from P. aeruginosa.
Nat.Chem.Biol., 19, 2023
8AC6
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BU of 8ac6 by Molmil
Nudaurelia capensis omega virus maturation intermediate captured at pH5.6 (insect cell expressed VLPs): medium class from symmetry expansion
Descriptor: p70
Authors:Castells-Graells, R, Hesketh, E.L, Johnson, J.E, Ranson, N.A, Lawson, D.M, Lomonossoff, G.P.
Deposit date:2022-07-05
Release date:2022-12-28
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (3.63 Å)
Cite:Decoding virus maturation with cryo-EM structures of intermediates
To be published
8AC5
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BU of 8ac5 by Molmil
Complex III2 from Yarrowia lipolytica, with decylubiquinol, oxidised, b-position
Descriptor: 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 1,2-DIMYRISTOYL-SN-GLYCERO-3-PHOSPHATE, CARDIOLIPIN, ...
Authors:Wieferig, J.P, Kuhlbrandt, W.
Deposit date:2022-07-05
Release date:2023-01-11
Last modified:2023-01-25
Method:ELECTRON MICROSCOPY (3.1 Å)
Cite:Analysis of the conformational heterogeneity of the Rieske iron-sulfur protein in complex III 2 by cryo-EM.
Iucrj, 10, 2023
8AC4
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BU of 8ac4 by Molmil
Complex III2 from Yarrowia lipolytica, apo, c-position
Descriptor: 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 1,2-DIMYRISTOYL-SN-GLYCERO-3-PHOSPHATE, CARDIOLIPIN, ...
Authors:Wieferig, J.P, Kuhlbrandt, W.
Deposit date:2022-07-05
Release date:2023-01-11
Last modified:2023-01-25
Method:ELECTRON MICROSCOPY (2.7 Å)
Cite:Analysis of the conformational heterogeneity of the Rieske iron-sulfur protein in complex III 2 by cryo-EM.
Iucrj, 10, 2023
8AC3
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BU of 8ac3 by Molmil
Complex III2 from Yarrowia lipolytica, apo, int-position
Descriptor: 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 1,2-DIMYRISTOYL-SN-GLYCERO-3-PHOSPHATE, CARDIOLIPIN, ...
Authors:Wieferig, J.P, Kuhlbrandt, W.
Deposit date:2022-07-05
Release date:2023-01-11
Last modified:2023-01-25
Method:ELECTRON MICROSCOPY (2.8 Å)
Cite:Analysis of the conformational heterogeneity of the Rieske iron-sulfur protein in complex III 2 by cryo-EM.
Iucrj, 10, 2023
8ABW
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BU of 8abw by Molmil
Crystal structure of SpLdpA in complex with threo-DGPD
Descriptor: (1R,2R)-1,2-bis(3-methoxy-4-oxidanyl-phenyl)propane-1,3-diol, (1S,2S)-1,2-bis(3-methoxy-4-oxidanyl-phenyl)propane-1,3-diol, SULFATE ION, ...
Authors:Zahn, M, Kuatsjah, E, Beckham, G.T, McGeehan, J.E.
Deposit date:2022-07-04
Release date:2023-02-01
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (1.83 Å)
Cite:Biochemical and structural characterization of a sphingomonad diarylpropane lyase for cofactorless deformylation.
Proc.Natl.Acad.Sci.USA, 120, 2023
8ABV
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BU of 8abv by Molmil
Crystal structure of SpLdpA in complex with erythro-DGPD
Descriptor: (1R,2S)-1,2-bis(3-methoxy-4-oxidanyl-phenyl)propane-1,3-diol, (1S,2R)-1,2-bis(3-methoxy-4-oxidanyl-phenyl)propane-1,3-diol, GLYCEROL, ...
Authors:Zahn, M, Kuatsjah, E, Beckham, G.T, McGeehan, J.E.
Deposit date:2022-07-04
Release date:2023-02-01
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (1.683 Å)
Cite:Biochemical and structural characterization of a sphingomonad diarylpropane lyase for cofactorless deformylation.
Proc.Natl.Acad.Sci.USA, 120, 2023
8ABU
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BU of 8abu by Molmil
Crystal structure of NaLdpA mutant H97Q in complex with erythro-DGPD
Descriptor: (1S,2R)-1,2-bis(3-methoxy-4-oxidanyl-phenyl)propane-1,3-diol, SnoaL-like domain-containing protein
Authors:Zahn, M, Kuatsjah, E, Beckham, G.T, McGeehan, J.E.
Deposit date:2022-07-04
Release date:2023-02-01
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.661 Å)
Cite:Biochemical and structural characterization of a sphingomonad diarylpropane lyase for cofactorless deformylation.
Proc.Natl.Acad.Sci.USA, 120, 2023
8ABT
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BU of 8abt by Molmil
Crystal structure of NaLdpA in complex with the product analog Resveratrol
Descriptor: RESVERATROL, SULFATE ION, SnoaL-like domain-containing protein
Authors:Zahn, M, Kuatsjah, E, Beckham, G.T, McGeehan, J.E.
Deposit date:2022-07-04
Release date:2023-02-01
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (1.39 Å)
Cite:Biochemical and structural characterization of a sphingomonad diarylpropane lyase for cofactorless deformylation.
Proc.Natl.Acad.Sci.USA, 120, 2023
8ABQ
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BU of 8abq by Molmil
Structure of the SNX1-SNX5 complex, Pt derivative
Descriptor: PLATINUM (II) ION, Sorting nexin-1, Sorting nexin-5
Authors:Lopez-Robles, C, Scaramuzza, S, Astorga-Simon, E.N, Banos-Mateos, S, Vidaurrazaga, A, Rojas, A.L, Castano, D, Hierro, A.
Deposit date:2022-07-04
Release date:2023-06-21
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (2.81 Å)
Cite:Architecture of the ESCPE-1 membrane coat.
Nat.Struct.Mol.Biol., 30, 2023
8ABO
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BU of 8abo by Molmil
Crystal structure of a staphylococcal orthologue of CYP134A1 (CYPX) in complex with a fragment
Descriptor: 4-PHENYL-1H-IMIDAZOLE, CYPX, NITRATE ION, ...
Authors:Snee, M, Katariya, M, Levy, C.
Deposit date:2022-07-04
Release date:2023-07-12
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Crystal structure of a staphylococcal orthologue of CYP134A1 (CYPX) in complex with a fragment
To Be Published
8ABM
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BU of 8abm by Molmil
Complex III2 from Yarrowia lipolytica, apo, b-position
Descriptor: 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 1,2-DIMYRISTOYL-SN-GLYCERO-3-PHOSPHATE, CARDIOLIPIN, ...
Authors:Wieferig, J.P, Kuhlbrandt, W.
Deposit date:2022-07-04
Release date:2023-01-11
Last modified:2023-01-25
Method:ELECTRON MICROSCOPY (2.8 Å)
Cite:Analysis of the conformational heterogeneity of the Rieske iron-sulfur protein in complex III 2 by cryo-EM.
Iucrj, 10, 2023

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數據於2024-09-11公開中

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