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3Q4R
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BU of 3q4r by Molmil
Crystal Structure of a deletion mutant(11-185) of hypothetical protein MJ0754 with Zn2+
分子名称: 2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Uncharacterized protein MJ0754, ZINC ION
著者Hwang, K.Y, Lee, E.H.
登録日2010-12-24
公開日2011-05-18
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Structural insights into the metal binding properties of hypothetical protein MJ0754 from Methanococcus jannaschii.
Proteins, 79, 2011
5F8E
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BU of 5f8e by Molmil
Rv2258c-SAH
分子名称: Methyltransferase, S-ADENOSYL-L-HOMOCYSTEINE
著者Im, H.N, Suh, S.W.
登録日2015-12-09
公開日2016-06-29
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Crystal structure of Rv2258c from Mycobacterium tuberculosis H37Rv, an S-adenosyl-l-methionine-dependent methyltransferase
J.Struct.Biol., 193, 2016
5F8F
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BU of 5f8f by Molmil
Rv2258c-SFG
分子名称: GLYCEROL, Methyltransferase, SINEFUNGIN
著者Im, H.N, Suh, S.W.
登録日2015-12-09
公開日2016-06-29
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Crystal structure of Rv2258c from Mycobacterium tuberculosis H37Rv, an S-adenosyl-l-methionine-dependent methyltransferase
J.Struct.Biol., 193, 2016
5F8C
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BU of 5f8c by Molmil
Rv2258c-unbound
分子名称: GLYCEROL, Methyltransferase
著者Im, H.N, Suh, S.W.
登録日2015-12-09
公開日2016-06-29
実験手法X-RAY DIFFRACTION (1.83 Å)
主引用文献Crystal structure of Rv2258c from Mycobacterium tuberculosis H37Rv, an S-adenosyl-l-methionine-dependent methyltransferase
J.Struct.Biol., 193, 2016
5GHV
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BU of 5ghv by Molmil
Crystal structure of an inhibitor-bound Syk
分子名称: 1-({1-[2-({3,5-dimethyl-4-[2-(pyrrolidin-1-yl)ethoxy]phenyl}amino)pyrimidin-4-yl]-4-methyl-1H-pyrrol-3-yl}methyl)azetidin-3-ol, Tyrosine-protein kinase SYK
著者Lee, S.J, Choi, J, Han, B.G, Song, H, Koh, J.S, Lee, B.I.
登録日2016-06-20
公開日2016-07-06
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Crystal structures of spleen tyrosine kinase in complex with novel inhibitors: structural insights for design of anticancer drugs
Febs J., 283, 2016
6HTF
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BU of 6htf by Molmil
Crystal structure of human Btk SH2 domain bound to rF10 repebody
分子名称: Tyrosine-protein kinase BTK, rF10 repebody
著者Duarte, D.P, Pojer, F, Hantschel, O.
登録日2018-10-04
公開日2020-05-20
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.102 Å)
主引用文献Btk SH2-kinase interface is critical for allosteric kinase activation and its targeting inhibits B-cell neoplasms.
Nat Commun, 11, 2020
7JTP
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BU of 7jtp by Molmil
Crystal structure of Protac MS67 in complex with the WD repeat-containing protein 5 and pVHL:ElonginC:ElonginB
分子名称: Elongin-B, Elongin-C, GLYCEROL, ...
著者Kottur, J, Jain, R, Aggarwal, A.K.
登録日2020-08-18
公開日2021-10-06
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.12 Å)
主引用文献A selective WDR5 degrader inhibits acute myeloid leukemia in patient-derived mouse models.
Sci Transl Med, 13, 2021
7JTO
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BU of 7jto by Molmil
Crystal structure of Protac MS33 in complex with the WD repeat-containing protein 5 and pVHL:ElonginC:ElonginB
分子名称: 1,2-ETHANEDIOL, 3-methyl-N-(11-{[2-(4-{[4'-(4-methylpiperazin-1-yl)-3'-{[6-oxo-4-(trifluoromethyl)-5,6-dihydropyridine-3-carbonyl]amino}[1,1'-biphenyl]-3-yl]methyl}piperazin-1-yl)ethyl]amino}-11-oxoundecanoyl)-L-valyl-(4R)-4-hydroxy-N-{[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl}-L-prolinamide, Elongin-B, ...
著者Kottur, J, Jain, R, Aggarwal, A.K.
登録日2020-08-18
公開日2021-10-06
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献A selective WDR5 degrader inhibits acute myeloid leukemia in patient-derived mouse models.
Sci Transl Med, 13, 2021
6AFP
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BU of 6afp by Molmil
Crystal structure of class A b-lactamase, PenL, variant Asn136Asp, from Burkholderia thailandensis, in complex with ceftazidime-like boronic acid
分子名称: ACETATE ION, Beta-lactamase, PINACOL[[2-AMINO-ALPHA-(1-CARBOXY-1-METHYLETHOXYIMINO)-4-THIAZOLEACETYL]AMINO]METHANEBORONATE
著者Cao, T.-P, Choi, J.M, Lee, S.H.
登録日2018-08-08
公開日2020-01-15
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.398 Å)
主引用文献Non-catalytic-Region Mutations Conferring Transition of Class A beta-Lactamases Into ESBLs.
Front Mol Biosci, 2020
6AFM
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BU of 6afm by Molmil
Crystal structure of class A b-lactamase, PenL, variant Cys69Tyr, from Burkholderia thailandensis
分子名称: Beta-lactamase
著者Cao, T.-P, Choi, J.M, Lee, S.H.
登録日2018-08-08
公開日2020-01-15
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献Non-catalytic-Region Mutations Conferring Transition of Class A beta-Lactamases Into ESBLs.
Front Mol Biosci, 2020
6AFO
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BU of 6afo by Molmil
Crystal structure of class A b-lactamase, PenL, variant Asn136Asp, from Burkholderia thailandensis
分子名称: Beta-lactamase
著者Cao, T.-P, Choi, J.M, Lee, S.H.
登録日2018-08-08
公開日2020-01-15
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.399 Å)
主引用文献Non-catalytic-Region Mutations Conferring Transition of Class A beta-Lactamases Into ESBLs.
Front Mol Biosci, 2020
6AFN
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BU of 6afn by Molmil
Crystal structure of class A b-lactamase, PenL, variant Cys69Tyr, from Burkholderia thailandensis, in complex with ceftazidime-like boronic acid
分子名称: Beta-lactamase, GLYCEROL, PINACOL[[2-AMINO-ALPHA-(1-CARBOXY-1-METHYLETHOXYIMINO)-4-THIAZOLEACETYL]AMINO]METHANEBORONATE
著者Cao, T.-P, Choi, J.M, Lee, S.H.
登録日2018-08-08
公開日2020-01-15
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Non-catalytic-Region Mutations Conferring Transition of Class A beta-Lactamases Into ESBLs.
Front Mol Biosci, 2020
7UX9
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BU of 7ux9 by Molmil
Arabidopsis DDM1 bound to nucleosome (H2A.W, H2B, H3.3, H4, with 147 bp DNA)
分子名称: ATP-dependent DNA helicase DDM1, DNA (antisense strand), DNA (sense strand), ...
著者Ipsaro, J.J, Adams, D.W, Joshua-Tor, L.
登録日2022-05-05
公開日2023-08-09
最終更新日2023-09-27
実験手法ELECTRON MICROSCOPY (3.2 Å)
主引用文献Chromatin remodeling of histone H3 variants by DDM1 underlies epigenetic inheritance of DNA methylation.
Cell, 186, 2023
5ENO
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BU of 5eno by Molmil
MBX2319 bound structure of bacterial efflux pump.
分子名称: 3,3-dimethyl-8-morpholin-4-yl-6-(2-phenylethylsulfanyl)-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile, DARPin, Multidrug efflux pump subunit AcrB,Multidrug efflux pump subunit AcrB
著者Sjuts, H, Ornik, A.R, Pos, K.M.
登録日2015-11-09
公開日2016-04-06
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Molecular basis for inhibition of AcrB multidrug efflux pump by novel and powerful pyranopyridine derivatives.
Proc.Natl.Acad.Sci.USA, 113, 2016
5ENS
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BU of 5ens by Molmil
Rhodamine bound structure of bacterial efflux pump.
分子名称: DARPin, Multidrug efflux pump subunit AcrB,Multidrug efflux pump subunit AcrB, RHODAMINE 6G
著者Sjuts, H, Ornik, A.R, Pos, K.M.
登録日2015-11-09
公開日2016-04-06
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Molecular basis for inhibition of AcrB multidrug efflux pump by novel and powerful pyranopyridine derivatives.
Proc.Natl.Acad.Sci.USA, 113, 2016
5ENP
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BU of 5enp by Molmil
MBX2931 bound structure of bacterial efflux pump.
分子名称: 6-[2-(3,4-dimethoxyphenyl)ethylsulfanyl]-8-[4-(2-methoxyethyl)piperazin-1-yl]-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile, DARPin, Multidrug efflux pump subunit AcrB,Multidrug efflux pump subunit AcrB
著者Sjuts, H, Ornik, A.R, Pos, K.M.
登録日2015-11-09
公開日2016-04-06
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Molecular basis for inhibition of AcrB multidrug efflux pump by novel and powerful pyranopyridine derivatives.
Proc.Natl.Acad.Sci.USA, 113, 2016
5ENQ
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BU of 5enq by Molmil
MBX3132 bound structure of bacterial efflux pump.
分子名称: DARPin, Multidrug efflux pump subunit AcrB,Multidrug efflux pump subunit AcrB, ~{N}-[4-[2-[[5-cyano-8-[(2~{S},6~{R})-2,6-dimethylmorpholin-4-yl]-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]ethanamide
著者Sjuts, H, Ornik, A.R, Pos, K.M.
登録日2015-11-09
公開日2016-04-06
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Molecular basis for inhibition of AcrB multidrug efflux pump by novel and powerful pyranopyridine derivatives.
Proc.Natl.Acad.Sci.USA, 113, 2016
5ENT
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BU of 5ent by Molmil
Minocycline bound structure of bacterial efflux pump.
分子名称: (4S,4AS,5AR,12AS)-4,7-BIS(DIMETHYLAMINO)-3,10,12,12A-TETRAHYDROXY-1,11-DIOXO-1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-2- CARBOXAMIDE, DARPin, DI(HYDROXYETHYL)ETHER, ...
著者Sjuts, H, Ornik, A.R, Pos, K.M.
登録日2015-11-09
公開日2016-04-06
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Molecular basis for inhibition of AcrB multidrug efflux pump by novel and powerful pyranopyridine derivatives.
Proc.Natl.Acad.Sci.USA, 113, 2016
5ENR
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BU of 5enr by Molmil
MBX3135 bound structure of bacterial efflux pump.
分子名称: DARPin, Multidrug efflux pump subunit AcrB,Multidrug efflux pump subunit AcrB, ~{N}-[4-[2-[[5-cyano-8-[(2~{S},6~{S})-2,6-dimethylmorpholin-4-yl]-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]prop-2-enamide
著者Sjuts, H, Ornik, A.R, Pos, K.M.
登録日2015-11-09
公開日2016-04-06
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Molecular basis for inhibition of AcrB multidrug efflux pump by novel and powerful pyranopyridine derivatives.
Proc.Natl.Acad.Sci.USA, 113, 2016
5EN5
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BU of 5en5 by Molmil
Apo structure of bacterial efflux pump.
分子名称: DARPin, Multidrug efflux pump subunit AcrB,Multidrug efflux pump subunit AcrB
著者Sjuts, H, Ornik, A.R, Pos, K.M.
登録日2015-11-09
公開日2016-04-06
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Molecular basis for inhibition of AcrB multidrug efflux pump by novel and powerful pyranopyridine derivatives.
Proc.Natl.Acad.Sci.USA, 113, 2016
5GTO
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BU of 5gto by Molmil
Human PPARgamma ligand binding dmain complexed with S35
分子名称: 2-[4-[5-[(1~{S})-1-[(3,5-dimethoxyphenyl)carbamoyl-(phenylmethyl)carbamoyl]oxypropyl]-1,2-oxazol-3-yl]phenoxy]-2-methyl-propanoic acid, GLYCEROL, MYRISTIC ACID, ...
著者Jang, J.Y, Suh, S.W.
登録日2016-08-22
公開日2017-07-05
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structural basis for differential activities of enantiomeric PPAR gamma agonists: Binding of S35 to the alternate site.
Biochim. Biophys. Acta, 1865, 2017
5GTP
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BU of 5gtp by Molmil
The agonist-free structure of human PPARgamma ligand binding domain in the presence of the SRC-1 coactivator peptide
分子名称: GLYCEROL, MYRISTIC ACID, Nuclear receptor coactivator 1, ...
著者Jang, J.Y, Suh, S.W.
登録日2016-08-23
公開日2017-07-05
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Structural basis for differential activities of enantiomeric PPAR gamma agonists: Binding of S35 to the alternate site.
Biochim. Biophys. Acta, 1865, 2017
4PKL
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BU of 4pkl by Molmil
Bromodomain of Trypanosoma brucei BDF2 With IBET-151
分子名称: 7-(3,5-DIMETHYL-1,2-OXAZOL-4-YL)-8-METHOXY-1-[(1R)-1-(PYRIDIN-2-YL)ETHYL]-1H,2H,3H-IMIDAZO[4,5-C]QUINOLIN-2-ONE, Bromodomain factor 2, CHLORIDE ION, ...
著者Debler, E.W.
登録日2014-05-15
公開日2015-11-18
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (1.251 Å)
主引用文献Bromodomain Proteins Contribute to Maintenance of Bloodstream Form Stage Identity in the African Trypanosome.
Plos Biol., 13, 2015
5XIX
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BU of 5xix by Molmil
The canonical domain of human asparaginyl-tRNA synthetase
分子名称: Asparagine--tRNA ligase, cytoplasmic, GLYCEROL
著者Park, J.S, Han, B.W.
登録日2017-04-28
公開日2018-05-02
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Unique N-terminal extension domain of human asparaginyl-tRNA synthetase elicits CCR3-mediated chemokine activity.
Int. J. Biol. Macromol., 120, 2018
6PY2
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BU of 6py2 by Molmil
HLA-TCR complex
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, DQ2.2-glut-L1, GLYCEROL, ...
著者Ting, Y.T, Peteren, J, Reid, H.H, Rossjohn, J.
登録日2019-07-28
公開日2020-01-15
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.82543421 Å)
主引用文献A molecular basis for the T cell response in HLA-DQ2.2 mediated celiac disease.
Proc.Natl.Acad.Sci.USA, 117, 2020

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