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5N0Q
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BU of 5n0q by Molmil
Crystal structure of OphA-DeltaC6 in complex with SAH
Descriptor: Peptide N-methyltransferase, S-ADENOSYL-L-HOMOCYSTEINE
Authors:Naismith, J.H, Song, H.
Deposit date:2017-02-03
Release date:2018-02-14
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.402 Å)
Cite:A molecular mechanism for the enzymatic methylation of nitrogen atoms within peptide bonds.
Sci Adv, 4, 2018
5N0P
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BU of 5n0p by Molmil
Crystal structure of OphA-DeltaC18 in complex with SAH
Descriptor: 1,2-ETHANEDIOL, S-ADENOSYL-L-HOMOCYSTEINE, peptide N-methyltranferase
Authors:Naismith, J.H, Song, H.
Deposit date:2017-02-03
Release date:2018-02-14
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.16 Å)
Cite:A molecular mechanism for the enzymatic methylation of nitrogen atoms within peptide bonds.
Sci Adv, 4, 2018
6YQQ
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BU of 6yqq by Molmil
ForT-PRPP complex
Descriptor: 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose, CHLORIDE ION, ForT-PRPP complex, ...
Authors:Naismith, J.H, Gao, S.
Deposit date:2020-04-18
Release date:2020-05-20
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Uncovering the chemistry of C-C bond formation in C-nucleoside biosynthesis: crystal structure of a C-glycoside synthase/PRPP complex.
Chem.Commun.(Camb.), 56, 2020
1DZT
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BU of 1dzt by Molmil
RMLC FROM SALMONELLA TYPHIMURIUM
Descriptor: 3'-O-ACETYLTHYMIDINE-(5' DIPHOSPHATE PHENYL ESTER), 3'-O-ACETYLTHYMIDINE-5'-DIPHOSPHATE, DTDP-4-DEHYDRORHAMNOSE 3,5-EPIMERASE, ...
Authors:Naismith, J.H, Giraud, M.F.
Deposit date:2000-03-07
Release date:2000-04-18
Last modified:2023-12-06
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Rmlc, the Third Enzyme of Dtdp-L-Rhamnose Pathway, is a New Class of Epimerase.
Nat.Struct.Biol., 7, 2000
1DZR
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BU of 1dzr by Molmil
RmlC from Salmonella typhimurium
Descriptor: DTDP-4-DEHYDRORHAMNOSE 3,5-EPIMERASE, GLYCEROL, SULFATE ION
Authors:Naismith, J.H, Giraud, M.F.
Deposit date:2000-03-07
Release date:2000-04-18
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.17 Å)
Cite:Rmlc, the Third Enzyme of Dtdp-L-Rhamnose Pathway, is a New Class of Epimerase.
Nat.Struct.Biol., 7, 2000
6Y47
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BU of 6y47 by Molmil
Crystal structure of the ferric enterobactin receptor (PfeA) in complex with BCV-L5
Descriptor: 1,2-ETHANEDIOL, FE (III) ION, Ferric enterobactin receptor, ...
Authors:Naismith, J.H, Moynie, L.M.
Deposit date:2020-02-19
Release date:2021-01-20
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (3.04 Å)
Cite:Hijacking of the Enterobactin Pathway by a Synthetic Catechol Vector Designed for Oxazolidinone Antibiotic Delivery in Pseudomonas aeruginosa.
Acs Infect Dis., 2022
6Z3C
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BU of 6z3c by Molmil
High resolution structure of RgNanOx
Descriptor: CITRATE ANION, Gfo/Idh/MocA family oxidoreductase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Naismith, J.H, Lee, M.O.
Deposit date:2020-05-19
Release date:2020-06-03
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.74 Å)
Cite:Uncovering a novel molecular mechanism for scavenging sialic acids in bacteria.
J.Biol.Chem., 295, 2020
6Z33
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BU of 6z33 by Molmil
Crystal structure of the ferric enterobactin receptor (PfeA) in complex with BCV
Descriptor: 1,2-ETHANEDIOL, FE (III) ION, Ferric enterobactin receptor, ...
Authors:Naismith, J.H, Moynie, L.M.
Deposit date:2020-05-19
Release date:2020-07-29
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.711 Å)
Cite:Hijacking of the Enterobactin Pathway by a Synthetic Catechol Vector Designed for Oxazolidinone Antibiotic Delivery in Pseudomonas aeruginosa.
Acs Infect Dis., 2022
6Z3B
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BU of 6z3b by Molmil
Low resolution structure of RgNanOx
Descriptor: CITRIC ACID, Gfo/Idh/MocA family oxidoreductase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Naismith, J.H, Lee, M.
Deposit date:2020-05-19
Release date:2020-07-22
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.58 Å)
Cite:Uncovering a novel molecular mechanism for scavenging sialic acids in bacteria.
J.Biol.Chem., 295, 2020
6Z2N
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BU of 6z2n by Molmil
Crystal structure of the ferric enterobactin receptor (PfeA) in complex with BCV-L6
Descriptor: 1,2-ETHANEDIOL, BCV-L6, FE (III) ION, ...
Authors:Naismith, J.H, Moynie, L.M.
Deposit date:2020-05-18
Release date:2021-01-20
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (3.029 Å)
Cite:Hijacking of the Enterobactin Pathway by a Synthetic Catechol Vector Designed for Oxazolidinone Antibiotic Delivery in Pseudomonas aeruginosa.
Acs Infect Dis., 2022
6YY5
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BU of 6yy5 by Molmil
Crystal structure of the ferric enterobactin receptor (PfeA) in complex with TCV_L5
Descriptor: FE (III) ION, Ferric enterobactin receptor, ~{N}-[2-[[(2~{S})-3-[[(2~{S})-3-[[1-[2-[2-[2-[4-[4-[5-(acetamidomethyl)-2-oxidanylidene-1,3-oxazolidin-3-yl]-2-fluoranyl-phenyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]ethoxy]ethyl]-1,2,3-triazol-4-yl]methylamino]-2-[[2,3-bis(oxidanyl)phenyl]carbonylamino]-3-oxidanylidene-propyl]amino]-2-[[2,3-bis(oxidanyl)phenyl]carbonylamino]-3-oxidanylidene-propyl]amino]-2-oxidanylidene-ethyl]-2,3-bis(oxidanyl)benzamide
Authors:Naismith, J.H, Moynie, L.M.
Deposit date:2020-05-04
Release date:2020-07-29
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.717 Å)
Cite:Hijacking of the Enterobactin Pathway by a Synthetic Catechol Vector Designed for Oxazolidinone Antibiotic Delivery in Pseudomonas aeruginosa.
Acs Infect Dis., 2022
6ZHD
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BU of 6zhd by Molmil
H11-H4 bound to Spike
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Nanobody H11-H4, ...
Authors:Clare, D.K, Naismith, J.H, Weckener, M, Vogirala, V.K.
Deposit date:2020-06-22
Release date:2020-07-29
Method:ELECTRON MICROSCOPY (3.7 Å)
Cite:H11-H4 bound to Spike
To Be Published
6ZH9
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BU of 6zh9 by Molmil
Ternary complex CR3022 H11-H4 and RBD (SARS-CoV-2)
Descriptor: CR3022 Light chain, CR3022 heavy, Nanobody H11-H4, ...
Authors:Naismith, J.H, Mikolajek, H, Le Bas, A.
Deposit date:2020-06-21
Release date:2020-09-02
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (3.31 Å)
Cite:Neutralizing nanobodies bind SARS-CoV-2 spike RBD and block interaction with ACE2.
Nat.Struct.Mol.Biol., 27, 2020
1FQ0
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BU of 1fq0 by Molmil
KDPG ALDOLASE FROM ESCHERICHIA COLI
Descriptor: CITRIC ACID, KDPG ALDOLASE
Authors:Naismith, J.H.
Deposit date:2000-09-01
Release date:2000-10-04
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Directed evolution of a new catalytic site in 2-keto-3-deoxy-6-phosphogluconate aldolase from Escherichia coli.
Structure, 9, 2001
1FWR
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BU of 1fwr by Molmil
CRYSTAL STRUCTURE OF KDPG ALDOLASE DOUBLE MUTANT K133Q/T161K
Descriptor: CITRIC ACID, KDPG ALDOLASE
Authors:Naismith, J.H, Buchanan, L.V.
Deposit date:2000-09-24
Release date:2000-10-04
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Directed evolution of a new catalytic site in 2-keto-3-deoxy-6-phosphogluconate aldolase from Escherichia coli.
Structure, 9, 2001
1QGL
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BU of 1qgl by Molmil
Room temperature structure of concanavalin A complexed to bivalent ligand
Descriptor: 1,3-DI(N-PROPYLOXY-A-MANNOPYRANOSYL)-CARBOMYL 5-METHYAZIDO-BENZENE, CALCIUM ION, MANGANESE (II) ION, ...
Authors:Naismith, J.H.
Deposit date:1999-04-30
Release date:1999-05-20
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2.66 Å)
Cite:On the Meaning of Affinity: Cluster Glycoside Effects and Concanavalin A
J.Am.Chem.Soc., 121, 1999
5H8C
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BU of 5h8c by Molmil
Truncated XPD
Descriptor: IRON/SULFUR CLUSTER, XPD/Rad3 related DNA helicase
Authors:Naismith, J.H, Constantinescu, D.
Deposit date:2015-12-23
Release date:2016-01-13
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.29 Å)
Cite:Mechanism of DNA loading by the DNA repair helicase XPD.
Nucleic Acids Res., 44, 2016
5H8W
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BU of 5h8w by Molmil
XPD mechanism
Descriptor: ATP-dependent DNA helicase Ta0057, DNA (5'-D(P*TP*AP*CP*GP*A)-3'), IRON/SULFUR CLUSTER, ...
Authors:Naismith, J.H, Constantinescu, D.
Deposit date:2015-12-24
Release date:2016-01-13
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Mechanism of DNA loading by the DNA repair helicase XPD.
Nucleic Acids Res., 44, 2016
2VL7
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BU of 2vl7 by Molmil
Structure of S. tokodaii Xpd4
Descriptor: PHOSPHATE ION, XPD
Authors:Naismith, J.H, Johnson, K.A, Oke, M, McMahon, S.A, Liu, L, White, M.F, Zawadski, M, Carter, L.G.
Deposit date:2008-01-08
Release date:2008-05-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Structure of the DNA Repair Helicase Xpd.
Cell(Cambridge,Mass.), 133, 2008
2V7I
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BU of 2v7i by Molmil
PrnB native
Descriptor: PRNB, PROTOPORPHYRIN IX CONTAINING FE, SULFATE ION
Authors:Naismith, J.H.
Deposit date:2007-07-30
Release date:2007-08-07
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:The Second Enzyme in Pyrrolnitrin Biosynthetic Pathway is Related to the Heme-Dependent Dioxygenase Superfamily
Biochemistry, 46, 2007
2VG0
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BU of 2vg0 by Molmil
Rv1086 citronellyl pyrophosphate complex
Descriptor: GERANYL DIPHOSPHATE, GLYCEROL, SHORT-CHAIN Z-ISOPRENYL DIPHOSPHATE SYNTHETASE
Authors:Naismith, J.H, Wang, W, Dong, C.
Deposit date:2007-11-07
Release date:2007-11-13
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:The structural basis of chain length control in Rv1086.
J. Mol. Biol., 381, 2008
2V81
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BU of 2v81 by Molmil
Native KDPGal structure
Descriptor: 2-DEHYDRO-3-DEOXY-6-PHOSPHOGALACTONATE ALDOLASE
Authors:Naismith, J.H.
Deposit date:2007-08-02
Release date:2007-08-14
Last modified:2018-03-28
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Characterization and crystal structure of Escherichia coli KDPGal aldolase.
Bioorg. Med. Chem., 16, 2008
2V7K
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BU of 2v7k by Molmil
PrnB D-tryptophan complex
Descriptor: D-TRYPTOPHAN, PRNB, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Naismith, J.H.
Deposit date:2007-07-30
Release date:2007-08-07
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:The Second Enzyme in Pyrrolnitrin Biosynthetic Pathway is Related to the Heme-Dependent Dioxygenase Superfamily
Biochemistry, 46, 2007
2VG2
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BU of 2vg2 by Molmil
Rv2361 with IPP
Descriptor: 3-METHYLBUT-3-ENYL TRIHYDROGEN DIPHOSPHATE, CHLORIDE ION, DIPHOSPHATE, ...
Authors:Naismith, J.H, Wang, W, Dong, C.
Deposit date:2007-11-07
Release date:2007-11-13
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:The structural basis of chain length control in Rv1086.
J. Mol. Biol., 381, 2008
2V7J
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BU of 2v7j by Molmil
PrnB L-tryptophan complex
Descriptor: PRNB, PROTOPORPHYRIN IX CONTAINING FE, SULFATE ION, ...
Authors:Naismith, J.H.
Deposit date:2007-07-30
Release date:2007-08-07
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2 Å)
Cite:The Second Enzyme in Pyrrolnitrin Biosynthetic Pathway is Related to the Heme-Dependent Dioxygenase Superfamily
Biochemistry, 46, 2007

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数据于2024-06-05公开中

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