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4PSG
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BU of 4psg by Molmil
Crystal Structure of C.elegans Thymidylate Synthase in complex with an inhibitor N(4)OHdCMP
Descriptor: 2'-deoxy-N-hydroxycytidine 5'-(dihydrogen phosphate), Thymidylate synthase
Authors:Wilk, P, Jarmula, A, Rode, W.
Deposit date:2014-03-07
Release date:2015-02-18
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Crystal Structure of C.elegans Thymidylate Synthase in complex with an inhibitor N(4)OHdCMP
To be Published
6TXH
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BU of 6txh by Molmil
Crystal structure of thermotoga maritima Ferritin in apo form
Descriptor: EICOSANE, Ferritin, GLYCEROL, ...
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 (2.198 Å)
Cite:A single residue can modulate nanocage assembly in salt dependent ferritin.
Nanoscale, 13, 2021
6TXL
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BU of 6txl by Molmil
Crystal structure of thermotoga maritima E65Q 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 (2.099 Å)
Cite:A single residue can modulate nanocage assembly in salt dependent ferritin.
Nanoscale, 13, 2021
6TXN
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BU of 6txn by Molmil
Crystal structure of thermotoga maritima Ferritin in apo form
Descriptor: EICOSANE, Ferritin, GLYCEROL, ...
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 (2.01 Å)
Cite:A single residue can modulate nanocage assembly in salt dependent ferritin.
Nanoscale, 13, 2021
6TXM
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BU of 6txm by Molmil
Crystal structure of thermotoga maritima E65R Ferritin
Descriptor: EICOSANE, Ferritin, GLYCEROL, ...
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 (2.198 Å)
Cite:A single residue can modulate nanocage assembly in salt dependent ferritin.
Nanoscale, 13, 2021
6TXJ
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BU of 6txj by Molmil
Crystal structure of thermotoga maritima A42V E65D Ferritin
Descriptor: EICOSANE, FE (III) ION, Ferritin, ...
Authors:Wilk, P, Grudnik, P, Kumar, M, Heddle, J, Chakraborti, S, Biela, A.P.
Deposit date:2020-01-14
Release date:2021-07-28
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.17 Å)
Cite:A single residue can modulate nanocage assembly in salt dependent ferritin.
Nanoscale, 13, 2021
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
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
4IQB
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BU of 4iqb by Molmil
High Resolution Crystal Structure of C.elegans Thymidylate Synthase
Descriptor: SULFATE ION, Thymidylate synthase
Authors:Wilk, P, Dowiercial, A, Banaszak, K, Jarmula, A, Rypniewski, W, Rode, W.
Deposit date:2013-01-11
Release date:2014-01-22
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.13 Å)
Cite:Crystal structures of nematode (parasitic T. spiralis and free living C. elegans), compared to mammalian, thymidylate synthases (TS). Molecular docking and molecular dynamics simulations in search for nematode-specific inhibitors of TS.
J. Mol. Graph. Model., 77, 2017
7PQ7
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BU of 7pq7 by Molmil
Crystal structure of Campylobacter jejuni DsbA1
Descriptor: TETRAETHYLENE GLYCOL, TRIETHYLENE GLYCOL, Thiol:disulfide interchange protein DsbA
Authors:Wilk, P, Orlikowska, M, Banas, A.M, Bocian-Ostrzycka, K.M, Jagusztyn-Krynicka, E.K.
Deposit date:2021-09-16
Release date:2021-12-29
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Interplay between DsbA1, DsbA2 and C8J_1298 Periplasmic Oxidoreductases of Campylobacter jejuni and Their Impact on Bacterial Physiology and Pathogenesis.
Int J Mol Sci, 22, 2021
7PQF
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BU of 7pqf by Molmil
Crystal structure of Campylobacter jejuni DsbA2
Descriptor: Thiol:disulfide interchange protein DsbA/DsbL
Authors:Wilk, P, Banas, A.M, Bocian-Ostrzycka, K.M, Jagusztyn-Krynicka, E.K.
Deposit date:2021-09-17
Release date:2021-12-29
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.82 Å)
Cite:Interplay between DsbA1, DsbA2 and C8J_1298 Periplasmic Oxidoreductases of Campylobacter jejuni and Their Impact on Bacterial Physiology and Pathogenesis.
Int J Mol Sci, 22, 2021
5M4Z
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BU of 5m4z by Molmil
Crystal structure of the complex of T.spiralis thymidylate synthase with N(4)-hydroxy-2'-deoxycytidine-5'-monophosphate, crystallized in the presence of N(5,10)-methylenetetrahydrofolate
Descriptor: GLYCEROL, Thymidylate synthase, [(2~{R},3~{S},5~{R})-5-[(4~{E})-4-hydroxyimino-2-oxidanylidene-1,3-diazinan-1-yl]-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate
Authors:Wilk, P, Maj, P, Jarmula, A, Dowiercial, A, Rode, W.
Deposit date:2016-10-19
Release date:2017-12-20
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.179 Å)
Cite:Molecular Mechanism of Thymidylate Synthase Inhibition by N 4 -Hydroxy-dCMP in View of Spectrophotometric and Crystallographic Studies.
Int J Mol Sci, 22, 2021
7B9P
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BU of 7b9p by Molmil
Structure of Ribonucleotide reductase from Rhodobacter sphaeroides
Descriptor: 2'-DEOXYADENOSINE 5'-TRIPHOSPHATE, MAGNESIUM ION, Vitamin B12-dependent ribonucleotide reductase
Authors:Wilk, P, Feiler, C, Loderer, C, Kabinger, F.
Deposit date:2020-12-14
Release date:2022-01-12
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (2.646 Å)
Cite:HUG Domain Is Responsible for Active Dimer Stabilization in an NrdJd Ribonucleotide Reductase.
Biochemistry, 61, 2022
5BY6
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BU of 5by6 by Molmil
Crystal structure of Trichinella spiralis thymidylate synthase complexed with dUMP
Descriptor: 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, 2,3-DIHYDROXY-1,4-DITHIOBUTANE, GLYCEROL, ...
Authors:Dowiercial, A, Jarmula, A, Rypniewski, W, Fraczyk, T, Wilk, P, Rode, W.
Deposit date:2015-06-10
Release date:2015-06-17
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal structures of nematode (parasitic T. spiralis and free living C. elegans), compared to mammalian, thymidylate synthases (TS). Molecular docking and molecular dynamics simulations in search for nematode-specific inhibitors of TS.
J. Mol. Graph. Model., 77, 2017
8P61
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BU of 8p61 by Molmil
Crystal structure of O'nyong'nyong virus capsid protease (106-256)
Descriptor: Capsid protein, GLYCEROL, SULFATE ION
Authors:Plewka, J, Chykunova, Y, Wilk, P, Sienczyk, M, Dubin, G, Pyrc, K.
Deposit date:2023-05-24
Release date:2024-03-06
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Autoinhibition of suicidal capsid protease from O'nyong'nyong virus.
Int.J.Biol.Macromol., 262, 2024
8A0F
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BU of 8a0f by Molmil
Crystal structure of human deoxyhypusine synthase variant K329A in complex with NAD and SPD
Descriptor: (4R)-2-METHYLPENTANE-2,4-DIOL, 1,2-ETHANEDIOL, Deoxyhypusine synthase, ...
Authors:Wator, E, Wilk, P, Grudnik, P.
Deposit date:2022-05-27
Release date:2023-04-05
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.64 Å)
Cite:Cryo-EM structure of human eIF5A-DHS complex reveals the molecular basis of hypusination-associated neurodegenerative disorders.
Nat Commun, 14, 2023
8A0G
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BU of 8a0g by Molmil
Human deoxyhypusine synthase with trapped transition state
Descriptor: (4R)-2-METHYLPENTANE-2,4-DIOL, 1,3-DIAMINOPROPANE, Deoxyhypusine synthase, ...
Authors:Wator, E, Wilk, P, Grudnik, P.
Deposit date:2022-05-27
Release date:2023-04-05
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.84 Å)
Cite:Cryo-EM structure of human eIF5A-DHS complex reveals the molecular basis of hypusination-associated neurodegenerative disorders.
Nat Commun, 14, 2023
8A0E
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BU of 8a0e by Molmil
CryoEM structure of DHS-eIF5A1 complex
Descriptor: Deoxyhypusine synthase, Eukaryotic translation initiation factor 5A, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ...
Authors:Wator, E, Wilk, P, Biela, A.P, Rawski, M, Grudnik, P.
Deposit date:2022-05-27
Release date:2023-04-05
Method:ELECTRON MICROSCOPY (2.8 Å)
Cite:Cryo-EM structure of human eIF5A-DHS complex reveals the molecular basis of hypusination-associated neurodegenerative disorders.
Nat Commun, 14, 2023
5FCT
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BU of 5fct by Molmil
Mouse thymidylate synthase in ternary complex with FdUMP and methylenetetrahydrofolate.
Descriptor: 5-FLUORO-2'-DEOXYURIDINE-5'-MONOPHOSPHATE, 5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACID, Thymidylate synthase
Authors:Dowiercial, A, Wilk, P, Jarmula, A, Rode, W.
Deposit date:2015-12-15
Release date:2016-10-26
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Mouse thymidylate synthase does not show the inactive conformation, observed for the human enzyme
Struct Chem, 2016
6XXI
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BU of 6xxi by Molmil
Crystal Structure of Human Deoxyhypusine Synthase in complex with NAD
Descriptor: (4R)-2-METHYLPENTANE-2,4-DIOL, 1,2-ETHANEDIOL, ACETATE ION, ...
Authors:Wator, E, Wilk, P, Grudnik, P.
Deposit date:2020-01-27
Release date:2020-04-15
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.679 Å)
Cite:Half Way to Hypusine-Structural Basis for Substrate Recognition by Human Deoxyhypusine Synthase.
Biomolecules, 10, 2020
6XXK
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BU of 6xxk by Molmil
Crystal Structure of Human Deoxyhypusine Synthase in complex with spermidine
Descriptor: (4R)-2-METHYLPENTANE-2,4-DIOL, 1,2-ETHANEDIOL, ACETATE ION, ...
Authors:Wator, E, Wilk, P, Grudnik, P.
Deposit date:2020-01-27
Release date:2020-04-15
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Half Way to Hypusine-Structural Basis for Substrate Recognition by Human Deoxyhypusine Synthase.
Biomolecules, 10, 2020
6XXM
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BU of 6xxm by Molmil
Crystal Structure of Human Deoxyhypusine Synthase in complex with putrescine
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 1,4-DIAMINOBUTANE, Deoxyhypusine synthase
Authors:Wator, E, Wilk, P, Grudnik, P.
Deposit date:2020-01-27
Release date:2020-04-15
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.67 Å)
Cite:Half Way to Hypusine-Structural Basis for Substrate Recognition by Human Deoxyhypusine Synthase.
Biomolecules, 10, 2020
6XXJ
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BU of 6xxj by Molmil
Crystal Structure of Human Deoxyhypusine Synthase in complex with spermidine and NAD
Descriptor: (4R)-2-METHYLPENTANE-2,4-DIOL, 1,2-ETHANEDIOL, ACETATE ION, ...
Authors:Wator, E, Wilk, P, Grudnik, P.
Deposit date:2020-01-27
Release date:2020-04-15
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.41 Å)
Cite:Half Way to Hypusine-Structural Basis for Substrate Recognition by Human Deoxyhypusine Synthase.
Biomolecules, 10, 2020
6XXH
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BU of 6xxh by Molmil
Crystal Structure of Human Deoxyhypusine Synthase in apo form
Descriptor: (4R)-2-METHYLPENTANE-2,4-DIOL, ACETATE ION, BETA-MERCAPTOETHANOL, ...
Authors:Wator, E, Wilk, P, Grudnik, P.
Deposit date:2020-01-27
Release date:2020-04-15
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.52 Å)
Cite:Half Way to Hypusine-Structural Basis for Substrate Recognition by Human Deoxyhypusine Synthase.
Biomolecules, 10, 2020
6XXL
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BU of 6xxl by Molmil
Crystal Structure of Human Deoxyhypusine Synthase in complex with spermine
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 1,2-ETHANEDIOL, ACETATE ION, ...
Authors:Wator, E, Wilk, P, Grudnik, P.
Deposit date:2020-01-27
Release date:2020-04-15
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.69 Å)
Cite:Half Way to Hypusine-Structural Basis for Substrate Recognition by Human Deoxyhypusine Synthase.
Biomolecules, 10, 2020

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數據於2024-05-15公開中

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