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PDB: 99 件
2FQ6
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BU of 2fq6 by Molmil
Cystathionine beta-lyase (cbl) from escherichia coli in complex with n-hydrazinocarbonylmethyl-2-trifluoromethyl-benzamide
分子名称: Cystathionine beta-lyase, PHOSPHORIC ACID MONO-(5-HYDROXY-6-METHYL-4-{[2-(2-TRIFLUOROMETHYL-BENZOYLAMINO)-ACETYL]-HYDRAZONOMETHYL}-PYRIDIN-3-YLMETHYL)ESTER
著者Junop, M.S.
登録日2006-01-17
公開日2006-12-26
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.78 Å)
主引用文献Inhibitors of bacterial cystathionine beta-lyase: leads for new antimicrobial agents and probes of enzyme structure and function.
J.Med.Chem., 50, 2007
8V2T
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BU of 8v2t by Molmil
Phosphoheptose isomerase GMHA from Burkholderia pseudomallei bound to inhibitor Mut148591
分子名称: 1,5,6-trideoxy-6,6-difluoro-1-(N-hydroxyformamido)-6-phosphono-D-ribo-hexitol, CHLORIDE ION, Phosphoheptose isomerase, ...
著者Junop, M.S, Brown, C, Szabla, R.
登録日2023-11-23
公開日2023-12-06
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.402 Å)
主引用文献Potentiating Activity of GmhA Inhibitors on Gram-Negative Bacteria.
J.Med.Chem., 67, 2024
8V4J
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BU of 8v4j by Molmil
Phosphoheptose isomerase GMHA from Burkholderia pseudomallei bound to inhibitor Mut148233
分子名称: 1-deoxy-1-[formyl(hydroxy)amino]-5-O-phosphono-D-ribitol, CHLORIDE ION, Phosphoheptose isomerase, ...
著者Junop, M.S, Brown, C, Szabla, R.
登録日2023-11-29
公開日2023-12-13
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.31 Å)
主引用文献Potentiating Activity of GmhA Inhibitors on Gram-Negative Bacteria.
J.Med.Chem., 67, 2024
1FW6
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BU of 1fw6 by Molmil
CRYSTAL STRUCTURE OF A TAQ MUTS-DNA-ADP TERNARY COMPLEX
分子名称: 5'-D(*GP*CP*GP*AP*CP*GP*CP*TP*AP*GP*CP*GP*TP*GP*CP*GP*GP*CP*TP*CP*GP*TP*C)-3', 5'-D(*GP*GP*AP*CP*GP*AP*GP*CP*CP*GP*CP*CP*GP*CP*TP*AP*GP*CP*GP*TP*CP*G)-3', ADENOSINE-5'-DIPHOSPHATE, ...
著者Junop, M.S, Obmolova, G, Rausch, K, Hsieh, P, Yang, W.
登録日2000-09-21
公開日2001-02-19
最終更新日2018-01-31
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Composite active site of an ABC ATPase: MutS uses ATP to verify mismatch recognition and authorize DNA repair.
Mol.Cell, 7, 2001
1FU1
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BU of 1fu1 by Molmil
CRYSTAL STRUCTURE OF HUMAN XRCC4
分子名称: ACETIC ACID, DNA REPAIR PROTEIN XRCC4
著者Junop, M, Modesti, M, Guarne, A, Gellert, M, Yang, W.
登録日2000-09-13
公開日2000-12-11
最終更新日2021-11-03
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Crystal structure of the Xrcc4 DNA repair protein and implications for end joining.
EMBO J., 19, 2000
2ANQ
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BU of 2anq by Molmil
Crystal Structure of E.coli DHFR in complex with NADPH and the inhibitor compound 10a.
分子名称: (2,5-dimethylbenzene-1,4-diyl)dimethanediyl bis(N-carbamimidoylcarbamimidothioate), Dihydrofolate reductase, MANGANESE (II) ION, ...
著者Summerfield, R.L, Daigle, D.M, Mayer, S, Jackson, S.G, Organ, M, Hughes, D.W, Brown, E.D, Junop, M.S.
登録日2005-08-11
公開日2006-07-25
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.13 Å)
主引用文献A 2.13 A Structure of E. coli Dihydrofolate Reductase Bound to a Novel Competitive Inhibitor Reveals a New Binding Surface Involving the M20 Loop Region
J.Med.Chem., 49, 2006
7UDI
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BU of 7udi by Molmil
Full-length dimer of DNA-Damage Response Protein C from Deinococcus radiodurans
分子名称: DNA damage response protein DdrC, SULFATE ION
著者Szabla, R, Li, M.C, Junop, M.S.
登録日2022-03-19
公開日2023-02-22
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.24 Å)
主引用文献Full-length dimer of DNA-Damage Response Protein C from Deinococcus radiodurans
To Be Published
2ANO
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BU of 2ano by Molmil
Crystal structure of E.coli dihydrofolate reductase in complex with NADPH and the inhibitor MS-SH08-17
分子名称: 1-{[N-(1-IMINO-GUANIDINO-METHYL)]SULFANYLMETHYL}-3-TRIFLUOROMETHYL-BENZENE, Dihydrofolate reductase, MANGANESE (II) ION, ...
著者Summerfield, R.L, Daigle, D.M, Mayer, S, Jackson, S.G, Organ, M, Hughes, D.W, Brown, E.D, Junop, M.S.
登録日2005-08-11
公開日2006-07-25
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.68 Å)
主引用文献A 2.13 A Structure of E. coli Dihydrofolate Reductase Bound to a Novel Competitive Inhibitor Reveals a New Binding Surface Involving the M20 Loop Region
J.Med.Chem., 49, 2006
7RUD
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BU of 7rud by Molmil
DAHP synthase complex with trifluoropyruvate oxime
分子名称: (2Z)-3,3,3-trifluoro-2-(hydroxyimino)propanoic acid, Phospho-2-dehydro-3-deoxyheptonate aldolase, Phe-sensitive
著者Heimhalt, M, Mukherjee, P, Grainger, R, Szabla, R, Brown, C, Turner, R, Junop, M.S, Berti, P.J.
登録日2021-08-16
公開日2021-11-17
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献An Inhibitor-in-Pieces Approach to DAHP Synthase Inhibition: Potent Enzyme and Bacterial Growth Inhibition.
Acs Infect Dis., 7, 2021
7RUE
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BU of 7rue by Molmil
DAHP synthase complexed with trifluoropyruvate semicarbazone
分子名称: (2E)-2-(2-carbamoylhydrazinylidene)-3,3,3-trifluoropropanoic acid, MANGANESE (II) ION, Phospho-2-dehydro-3-deoxyheptonate aldolase, ...
著者Heimhalt, M, Mukherjee, P, Grainger, R, Szabla, R, Brown, C, Turner, R, Junop, M.S, Berti, P.J.
登録日2021-08-16
公開日2021-11-17
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献An Inhibitor-in-Pieces Approach to DAHP Synthase Inhibition: Potent Enzyme and Bacterial Growth Inhibition.
Acs Infect Dis., 7, 2021
6MC8
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BU of 6mc8 by Molmil
Crystal structure of PprA dimer from Deinococcus deserti
分子名称: DNA repair protein PprA
著者Szabla, R, Junop, M.S, Rok, M.
登録日2018-08-30
公開日2018-09-19
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Crystal structure of PprA from Deinococcus radiodurans
To Be Published
6NEO
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BU of 6neo by Molmil
Crystal structure of PprA filament from Deinococcus radiodurans
分子名称: DNA repair protein PprA
著者Szabla, R, Junop, M.S, Rok, M.
登録日2018-12-18
公開日2019-02-20
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (5.94 Å)
主引用文献Crystal structure of PprA filament from Deinococcus radiodurans
To Be Published
4MAL
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BU of 4mal by Molmil
TPR3 of FimV from P. aeruginosa (PAO1)
分子名称: Motility protein FimV
著者Nguyen, Y, Zhang, K, Daniel-Ivad, M, Sugiman-Marangos, S.N, Junop, M.S, Burrows, L.L, Howell, P.L.
登録日2013-08-16
公開日2014-08-20
最終更新日2016-02-24
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Crystal structure of TPR2 from FimV
To be Published
3B6C
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BU of 3b6c by Molmil
Crystal structure of the Streptomyces coelicolor TetR family protein ActR in complex with (S)-DNPA
分子名称: ActII protein, [(3S)-9-hydroxy-1-methyl-10-oxo-4,10-dihydro-3H-benzo[g]isochromen-3-yl]acetic acid
著者Willems, A.R, Junop, M.S.
登録日2007-10-28
公開日2008-02-05
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Crystal structures of the Streptomyces coelicolor TetR-like protein ActR alone and in complex with actinorhodin or the actinorhodin biosynthetic precursor (S)-DNPA.
J.Mol.Biol., 376, 2008
3B6A
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BU of 3b6a by Molmil
Crystal structure of the Streptomyces coelicolor TetR family protein ActR in complex with actinorhodin
分子名称: 2,2'-[(1R,1'R,3S,3'S)-6,6',9,9'-tetrahydroxy-1,1'-dimethyl-5,5',10,10'-tetraoxo-3,3',4,4',5,5',10,10'-octahydro-1H,1'H-8,8'-bibenzo[g]isochromene-3,3'-diyl]diacetic acid, ActR protein
著者Willems, A.R, Junop, M.S.
登録日2007-10-28
公開日2008-02-05
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (3.05 Å)
主引用文献Crystal structures of the Streptomyces coelicolor TetR-like protein ActR alone and in complex with actinorhodin or the actinorhodin biosynthetic precursor (S)-DNPA.
J.Mol.Biol., 376, 2008
4MBQ
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BU of 4mbq by Molmil
TPR3 of FimV from P. aeruginosa (PAO1)
分子名称: Motility protein FimV
著者Nguyen, Y, Zhang, K, Daniel-Ivad, M, Robinson, H, Wolfram, F, Sugiman-Marangos, S.N, Junop, M.S, Burrows, L.L, Howell, P.L.
登録日2013-08-19
公開日2014-08-20
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.006 Å)
主引用文献Crystal structure of TPR2 from FimV
To be Published
5UVR
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BU of 5uvr by Molmil
The core region of PilO from the type IV pilus system of Pseudomonas aeruginosa
分子名称: PilO protein
著者Howell, P.L, Junop, M.S.
登録日2017-02-20
公開日2018-02-21
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Conserved, unstructured regions in Pseudomonas aeruginosa PilO are important for type IVa pilus function.
Sci Rep, 8, 2018
6ED7
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BU of 6ed7 by Molmil
Crystal structure of 7,8-diaminopelargonic acid synthase bound to inhibitor MAC13772
分子名称: 2-[(2-nitrophenyl)sulfanyl]acetohydrazide, 7,8-diamino-pelargonic acid aminotransferase, PYRIDOXAL-5'-PHOSPHATE
著者Brown, C.M, Zlitni, S, Chan, J, Brown, E.D, Junop, M.S.
登録日2018-08-08
公開日2019-08-21
最終更新日2020-01-08
実験手法X-RAY DIFFRACTION (2.43 Å)
主引用文献Crystal structure of 7,8-diaminopelargonic acid synthase bound to inhibitor MAC13772
To Be Published
6O5L
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BU of 6o5l by Molmil
Crystal structure of PprA filament from Deinococcus peraridilitoris
分子名称: PprA
著者Szabla, R, Junop, M.S, Rok, M.
登録日2019-03-04
公開日2019-03-13
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (3.3 Å)
主引用文献Crystal structure of PprA filament from Deinococcus peraridilitoris
To Be Published
6BDU
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BU of 6bdu by Molmil
Crystal structure of PprA from Deinococcus radiodurans
分子名称: DNA repair protein PprA
著者Szabla, R, Czerwinski, M, Junop, M.S.
登録日2017-10-24
公開日2018-09-05
最終更新日2020-01-08
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Crystal structure of PprA from Deinococcus radiodurans
To Be Published
1ZM0
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BU of 1zm0 by Molmil
Crystal Structure of the Carboxyl Terminal PH Domain of Pleckstrin To 2.1 Angstroms
分子名称: Pleckstrin
著者Jackson, S.G, Zhang, Y, Zhang, K, Summerfield, R, Haslam, R.J, Junop, M.S.
登録日2005-05-09
公開日2006-02-28
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structure of the carboxy-terminal PH domain of pleckstrin at 2.1 Angstroms.
Acta Crystallogr.,Sect.D, 62, 2006
2OPT
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BU of 2opt by Molmil
Crystal Structure of Apo ActR from Streptomyces coelicolor.
分子名称: ActII protein
著者Willems, A.R, Junop, M.S.
登録日2007-01-30
公開日2008-02-05
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Crystal structures of the Streptomyces coelicolor TetR-like protein ActR alone and in complex with actinorhodin or the actinorhodin biosynthetic precursor (S)-DNPA.
J.Mol.Biol., 376, 2008
5EWP
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BU of 5ewp by Molmil
ARO (armadillo repeats only protein) from Plasmodium falciparum
分子名称: ARO (armadillo repeats only protein)
著者Brown, C, Zhang, K, Emery, J, Prusty, D, Wetzel, J, Heincke, D, Gilberger, T, Junop, M.
登録日2015-11-20
公開日2016-01-27
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献ARO (armadillo repeats only protein) from Plasmodium falciparum
To Be Published
6MC6
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BU of 6mc6 by Molmil
Crystal structure of PprA filament from Deinococcus radiodurans
分子名称: DNA repair protein PprA
著者Szabla, R, Junop, M.S, Wood, K.
登録日2018-08-30
公開日2018-09-26
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.747 Å)
主引用文献Crystal structure of PprA from Deinococcus radiodurans
To Be Published
4HQB
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BU of 4hqb by Molmil
Crystal structure of DdrB from Deinococcus radiodurans bound to ssDNA
分子名称: 5'-D(*TP*TP*TP*T)-3', 5'-D(P*TP*TP*TP*TP*T)-3', Single-stranded DNA-binding protein DdrB
著者Sugiman-Marangos, S.N, Junop, M.S.
登録日2012-10-25
公開日2013-09-04
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.301 Å)
主引用文献Crystal structure of the DdrB/ssDNA complex from Deinococcus radiodurans reveals a DNA binding surface involving higher-order oligomeric states.
Nucleic Acids Res., 41, 2013

 

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