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3GPU
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BU of 3gpu by Molmil
MutM encountering an intrahelical 8-oxoguanine (oxoG) lesion in EC4-loop deletion complex
分子名称: DNA (5'-D(*AP*GP*GP*TP*AP*GP*AP*CP*TP*CP*GP*GP*AP*CP*GP*C)-3'), DNA (5'-D(*TP*GP*CP*GP*TP*CP*CP*(8OG)P*AP*GP*TP*CP*TP*AP*CP*C)-3'), DNA glycosylase, ...
著者Banerjee, A, Qi, Y, Verdine, G.L.
登録日2009-03-23
公開日2009-11-10
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.62 Å)
主引用文献Encounter and extrusion of an intrahelical lesion by a DNA repair enzyme.
Nature, 462, 2009
3GQ3
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BU of 3gq3 by Molmil
MutM encountering an intrahelical 8-oxoguanine (oxoG) lesion in EC5-loop deletion complex
分子名称: DNA (5'-D(*AP*GP*GP*TP*AP*GP*AP*CP*CP*CP*GP*GP*AP*CP*GP*C)-3'), DNA (5'-D(*TP*GP*CP*GP*TP*CP*CP*GP*(8OG)P*GP*TP*CP*TP*AP*CP*C)-3'), DNA glycosylase, ...
著者Banerjee, A, Qi, Y, Verdine, G.L.
登録日2009-03-23
公開日2009-11-10
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.83 Å)
主引用文献Encounter and extrusion of an intrahelical lesion by a DNA repair enzyme.
Nature, 462, 2009
1BQB
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BU of 1bqb by Molmil
AUREOLYSIN, STAPHYLOCOCCUS AUREUS METALLOPROTEINASE
分子名称: CALCIUM ION, PROTEIN (AUREOLYSIN), ZINC ION
著者Medrano, F.J, Banbula, A, Potempa, J, Travis, J, Bode, W.
登録日1998-07-14
公開日1999-01-13
最終更新日2023-08-09
実験手法X-RAY DIFFRACTION (1.72 Å)
主引用文献Amino-acid sequence and three-dimensional structure of the Staphylococcus aureus metalloproteinase at 1.72 A resolution.
Structure, 6, 1998
2NOL
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BU of 2nol by Molmil
Structure of catalytically inactive human 8-oxoguanine glycosylase distal crosslink to oxoG DNA
分子名称: 5'-D(*GP*CP*GP*TP*CP*CP*AP*(G42)P*GP*TP*CP*TP*AP*CP*C)-3', 5'-D(*GP*GP*TP*AP*GP*AP*CP*CP*TP*GP*GP*AP*CP*GP*C)-3', CALCIUM ION, ...
著者Banerjee, A, Radom, C.T, Verdine, G.L.
登録日2006-10-25
公開日2006-11-21
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (2.57 Å)
主引用文献Structural characterization of human 8-oxoguanine DNA glycosylase variants bearing active site mutations.
J.Biol.Chem., 282, 2007
7ASD
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BU of 7asd by Molmil
Structure of native royal jelly filaments
分子名称: (3beta,14beta,17alpha)-ergosta-5,24(28)-dien-3-ol, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Mattei, S, Ban, A, Picenoni, A, Leibundgut, M, Glockshuber, R, Boehringer, D.
登録日2020-10-27
公開日2020-12-30
実験手法ELECTRON MICROSCOPY (3.5 Å)
主引用文献Structure of native glycolipoprotein filaments in honeybee royal jelly.
Nat Commun, 11, 2020
7NEN
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BU of 7nen by Molmil
Crystal structure of outer surface protein C (OspC) from Borrelia garinii
分子名称: Outer surface protein C
著者Sliwiak, J, Bierwagen, P, Ruszkowski, M, Jaskolski, M, Urbanowicz, A.
登録日2021-02-04
公開日2021-04-07
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.98 Å)
主引用文献Structural studies of outer surface proteins (OspC) from different Borrelia strains
To Be Published
5W7I
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BU of 5w7i by Molmil
X-ray structure of ankyrin repeat domain of DHHC17 in complex with Snap25b peptide
分子名称: Palmitoyltransferase ZDHHC17, Snap25b-111-120
著者Verardi, R, Kim, J.-S, Ghirlando, R, Banerjee, A.
登録日2017-06-20
公開日2017-08-09
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.105 Å)
主引用文献Structural Basis for Substrate Recognition by the Ankyrin Repeat Domain of Human DHHC17 Palmitoyltransferase.
Structure, 25, 2017
6R7V
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BU of 6r7v by Molmil
Tannerella forsythia promirolysin mutant E225A
分子名称: CALCIUM ION, GLYCEROL, Mirolysin, ...
著者Rodriguez-Banqueri, A, Guevara, T, Ksiazek, M, Potempa, J, Gomis-Ruth, F.X.
登録日2019-03-29
公開日2019-11-13
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Structure-based mechanism of cysteine-switch latency and of catalysis by pappalysin-family metallopeptidases.
Iucrj, 7, 2020
6R7W
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BU of 6r7w by Molmil
Tannerella forsythia mature mirolysin in complex with a cleaved peptide.
分子名称: CALCIUM ION, CITRIC ACID, ETHANOL, ...
著者Rodriguez-Banqueri, A, Guevara, T, Ksiazek, M, Potempa, J, Gomis-Ruth, F.X.
登録日2019-03-29
公開日2019-11-13
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Structure-based mechanism of cysteine-switch latency and of catalysis by pappalysin-family metallopeptidases.
Iucrj, 7, 2020
7Z5F
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BU of 7z5f by Molmil
VP2-only capsid of MVM D263A mutant
分子名称: Capsid protein VP1
著者Luque, D, Ortega-Esteban, A, Valbuena, A, Vilas, J.L, Rodriguez-Huete, A, Mateu, M.G, Caston, J.R.
登録日2022-03-09
公開日2023-03-08
最終更新日2024-07-17
実験手法ELECTRON MICROSCOPY (3.22 Å)
主引用文献Equilibrium Dynamics of a Biomolecular Complex Analyzed at Single-amino Acid Resolution by Cryo-electron Microscopy.
J.Mol.Biol., 435, 2023
7Z5E
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BU of 7z5e by Molmil
VP2-only capsid of MVM D263A mutant
分子名称: Capsid protein VP1
著者Luque, D, Ortega-Esteban, A, Valbuena, A, Vilas, J.L, Rodriguez-Huete, A, Mateu, M.G, Caston, J.R.
登録日2022-03-09
公開日2023-03-08
最終更新日2024-07-17
実験手法ELECTRON MICROSCOPY (3.32 Å)
主引用文献Equilibrium Dynamics of a Biomolecular Complex Analyzed at Single-amino Acid Resolution by Cryo-electron Microscopy.
J.Mol.Biol., 435, 2023
7Z5D
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BU of 7z5d by Molmil
VP2-only capsid of wt MVM prototype strain p
分子名称: Capsid protein VP1
著者Luque, D, Ortega-Esteban, A, Valbuena, A, Vilas, J.L, Rodriguez-Huete, A, Mateu, M.G, Caston, J.R.
登録日2022-03-09
公開日2023-03-08
最終更新日2024-07-17
実験手法ELECTRON MICROSCOPY (3.42 Å)
主引用文献Equilibrium Dynamics of a Biomolecular Complex Analyzed at Single-amino Acid Resolution by Cryo-electron Microscopy.
J.Mol.Biol., 435, 2023
7SKM
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BU of 7skm by Molmil
Complex between S. aureus aureolysin and wt IMPI.
分子名称: 1,2-ETHANEDIOL, CALCIUM ION, DI(HYDROXYETHYL)ETHER, ...
著者Mendes, S.R, Eckhard, U, Rodriguez-Banqueri, A, Guevara, T, Gomis-Ruth, F.X.
登録日2021-10-21
公開日2022-01-26
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献An engineered protein-based submicromolar competitive inhibitor of the Staphylococcus aureus virulence factor aureolysin
Comput Struct Biotechnol J, 20, 2022
7SKL
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BU of 7skl by Molmil
Complex between S. aureus aureolysin and IMPI mutant I57I
分子名称: 1,2-ETHANEDIOL, CALCIUM ION, IMPI alpha, ...
著者Mendes, S.R, Eckhard, U, Rodriguez-Banqueri, A, Guevara, T, Gomis-Ruth, F.X.
登録日2021-10-21
公開日2022-01-26
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献An engineered protein-based submicromolar competitive inhibitor of the Staphylococcus aureus virulence factor aureolysin
Comput Struct Biotechnol J, 20, 2022
3DCV
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BU of 3dcv by Molmil
Crystal structure of human Pim1 kinase complexed with 4-(4-hydroxy-3-methyl-phenyl)-6-phenylpyrimidin-2(1H)-one
分子名称: 4-(4-hydroxy-3-methylphenyl)-6-phenylpyrimidin-2(5H)-one, Proto-oncogene serine/threonine-protein kinase Pim-1
著者Bellamacina, C.R, Shafer, C.M, Lindvall, M, Gesner, T.G, Yabannavar, A, Weiping, J, Song, L, Walter, A.
登録日2008-06-04
公開日2008-08-19
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献4-(1H-indazol-5-yl)-6-phenylpyrimidin-2(1H)-one analogs as potent CDC7 inhibitors.
Bioorg.Med.Chem.Lett., 18, 2008
5WMB
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BU of 5wmb by Molmil
Structure of the 10S (-)-cis-BP-dG modified Rev1 ternary complex (the BP residue is disordered)
分子名称: 1,2-ETHANEDIOL, 2'-DEOXYCYTIDINE-5'-TRIPHOSPHATE, DI(HYDROXYETHYL)ETHER, ...
著者Rechkoblit, O, Kolbanovsky, A, Landes, H, Geacintov, N.E, Aggarwal, A.K.
登録日2017-07-28
公開日2017-10-25
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Mechanism of error-free replication across benzo[a]pyrene stereoisomers by Rev1 DNA polymerase.
Nat Commun, 8, 2017
5W7J
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BU of 5w7j by Molmil
X-ray structure of the E89A variant of ankyrin repeat domain of DHHC17 in complex with Snap25b peptide
分子名称: Palmitoyltransferase ZDHHC17, Snap25b-111-120
著者Verardi, R, Kim, J.-S, Ghirlando, R, Banerjee, A.
登録日2017-06-20
公開日2017-08-09
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.202 Å)
主引用文献Structural Basis for Substrate Recognition by the Ankyrin Repeat Domain of Human DHHC17 Palmitoyltransferase.
Structure, 25, 2017
6I9A
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BU of 6i9a by Molmil
Porphyromonas gingivalis gingipain K (Kgp) in complex with inhibitor KYT-36
分子名称: (2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-DIOL, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, CALCIUM ION, ...
著者Gomis-Ruth, F.X, Guevara, T, Rofdriguez-Banqueri, A.
登録日2018-11-22
公開日2019-03-13
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.2 Å)
主引用文献Structural determinants of inhibition of Porphyromonas gingivalis gingipain K by KYT-36, a potent, selective, and bioavailable peptidase inhibitor.
Sci Rep, 9, 2019
6R7U
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BU of 6r7u by Molmil
Selenomethionine variant of Tannerella forsythia promirolysin mutant E225A
分子名称: BORIC ACID, CALCIUM ION, GLYCEROL, ...
著者Rodriguez-Banqueri, A, Guevara, T, Ksiazek, M, Potempa, J, Gomis-Ruth, F.X.
登録日2019-03-29
公開日2020-02-05
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Structure-based mechanism of cysteine-switch latency and of catalysis by pappalysin-family metallopeptidases.
Iucrj, 7, 2020
7BML
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BU of 7bml by Molmil
Crystal structure of outer surface protein C (OspC) from Borrelia burgdorferi
分子名称: Outer surface protein C
著者Sliwiak, J, Bierwagen, P, Ruszkowski, M, Jaskolski, M, Urbanowicz, A.
登録日2021-01-20
公開日2021-02-10
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Structural studies of outer surface proteins (OspC) from different Borrelia strains
To Be Published
5C1V
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BU of 5c1v by Molmil
CRYSTAL STRUCTURE ANALYSIS OF CATALYTIC SUBUNIT OF HUMAN CALCINEURIN
分子名称: FE (III) ION, PHOSPHATE ION, Serine/threonine-protein phosphatase 2B catalytic subunit alpha isoform, ...
著者Guasch, A, Fita, I, Perez-Luque, R, Aparicio, D, Aranguren-Ibanez, A, Perez-Riba, M.
登録日2015-06-15
公開日2016-02-03
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (3.35 Å)
主引用文献Calcineurin Undergoes a Conformational Switch Evoked via Peptidyl-Prolyl Isomerization.
Plos One, 10, 2015
7JNO
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BU of 7jno by Molmil
X-ray crystallographic structure of the NS3 helicase domain from Tick-borne encephalitis virus
分子名称: Serine protease NS3
著者Weeks, S.D, Munwar, A, Lucero, H.A, Bandara, A, Munawar, A.H.
登録日2020-08-05
公開日2020-08-19
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Crystal structure of Tickborne Encephalitis Virus NS3-Helicase and implications for drug design
To Be Published
5ZHP
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BU of 5zhp by Molmil
M3 muscarinic acetylcholine receptor in complex with a selective antagonist
分子名称: (1R,2R,4S,5S,7s)-7-({[4-fluoro-2-(thiophen-2-yl)phenyl]carbamoyl}oxy)-9,9-dimethyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]nonan-9-ium, CITRIC ACID, HEXAETHYLENE GLYCOL, ...
著者Liu, H, Hofmann, J, Fish, I, Schaake, B, Eitel, K, Bartuschat, A, Kaindl, J, Rampp, H, Banerjee, A, Hubner, H, Clark, M.J, Vincent, S.G, Fisher, J, Heinrich, M, Hirata, K, Liu, X, Sunahara, R.K, Shoichet, B.K, Kobilka, B.K, Gmeiner, P.
登録日2018-03-13
公開日2018-11-28
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献Structure-guided development of selective M3 muscarinic acetylcholine receptor antagonists
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
1FJ5
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BU of 1fj5 by Molmil
TAMOXIFEN-DNA ADDUCT
分子名称: (Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)-PHENOXY]-N,N-DIMETHYLETHANAMINIUM, DNA (5'-D(*CP*CP*AP*TP*CP*GP*CP*TP*AP*CP*C)-3'), DNA (5'-D(*GP*GP*TP*AP*GP*CP*GP*AP*TP*GP*G)-3')
著者Shimotakahara, S, Gorin, A, Kolbanovskiy, A, Kettani, A, Hingerty, B.E, Amin, S, Broyde, S, Geacintov, N, Patel, D.J.
登録日2000-08-07
公開日2000-09-11
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Accomodation of S-cis-tamoxifen-N(2)-guanine adduct within a bent and widened DNA minor groove.
J.Mol.Biol., 302, 2000
8B2N
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BU of 8b2n by Molmil
Potempin A (PotA) from Tannerella forsythia in complex with the catalytic domain of human MMP-12
分子名称: CALCIUM ION, Macrophage metalloelastase, Tannerella forsythia potempin A (PotA), ...
著者Potempa, J, Ksiazek, M, Goulas, T, Cuppari, A, Rodriguez-Banqueri, A, Arolas, J.L, Lopez-Pelegrin, M, Garcia-Ferrer, I, Guevara, T.
登録日2022-09-14
公開日2022-12-21
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献A unique network of attack, defence and competence on the outer membrane of the periodontitis pathogen Tannerella forsythia.
Chem Sci, 14, 2023

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