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2MBC
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BU of 2mbc by Molmil
Solution Structure of human holo-PRL-3 in complex with vanadate
分子名称: Protein tyrosine phosphatase type IVA 3
著者Jeong, K, Kang, D, Kim, J, Shin, S, Jin, B, Lee, C, Kim, E, Jeon, Y.H, Kim, Y.
登録日2013-07-29
公開日2013-10-09
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Structure and backbone dynamics of vanadate-bound PRL-3: comparison of 15N nuclear magnetic resonance relaxation profiles of free and vanadate-bound PRL-3.
Biochemistry, 53, 2014
5KOZ
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BU of 5koz by Molmil
Structure function studies of R. palustris RubisCO (K192C mutant; CABP-bound)
分子名称: 2-CARBOXYARABINITOL-1,5-DIPHOSPHATE, CARBONATE ION, MAGNESIUM ION, ...
著者Arbing, M.A, North, J.A, Satagopan, S, Tabita, F.R.
登録日2016-07-01
公開日2017-07-05
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structure function studies of R. palustris RubisCO.
To Be Published
3OGI
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BU of 3ogi by Molmil
Crystal structure of the Mycobacterium tuberculosis H37Rv EsxOP complex (Rv2346c-Rv2347c)
分子名称: Putative ESAT-6-like protein 6, Putative ESAT-6-like protein 7
著者Arbing, M.A, Chan, S, Zhou, T.T, Ahn, C, Harris, L, Kuo, E, Sawaya, M.R, Cascio, D, Eisenberg, D, Integrated Center for Structure and Function Innovation (ISFI), TB Structural Genomics Consortium (TBSGC)
登録日2010-08-16
公開日2010-08-25
最終更新日2014-05-21
実験手法X-RAY DIFFRACTION (2.549 Å)
主引用文献Heterologous expression of mycobacterial Esx complexes in Escherichia coli for structural studies is facilitated by the use of maltose binding protein fusions.
Plos One, 8, 2013
3UID
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BU of 3uid by Molmil
Crystal Structure of Protein Ms6760 from Mycobacterium smegmatis
分子名称: Putative uncharacterized protein
著者Bajaj, R.A, Miallau, L, Cascio, D, Arbing, M, Eisenberg, D, TB Structural Genomics Consortium (TBSGC)
登録日2011-11-04
公開日2011-11-23
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.571 Å)
主引用文献Crystal structure of the toxin Msmeg_6760, the structural homolog of Mycobacterium tuberculosis Rv2035, a novel type II toxin involved in the hypoxic response.
Acta Crystallogr F Struct Biol Commun, 72, 2016
4GZR
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BU of 4gzr by Molmil
Crystal structure of the Mycobacterium tuberculosis H37Rv EsxOP (Rv2346c-Rv2347c) complex in space group C2221
分子名称: ESAT-6-like protein 6, ESAT-6-like protein 7, SULFATE ION
著者Arbing, M.A, Chan, S, He, Q, Harris, L, Zhou, T.T, Kuo, E, Ahn, C.J, Eisenberg, D, TB Structural Genomics Consortium (TBSGC), Integrated Center for Structure and Function Innovation (ISFI)
登録日2012-09-06
公開日2012-09-26
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.553 Å)
主引用文献Heterologous expression of mycobacterial Esx complexes in Escherichia coli for structural studies is facilitated by the use of maltose binding protein fusions.
Plos One, 8, 2013
4I0X
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BU of 4i0x by Molmil
Crystal structure of the Mycobacterum abscessus EsxEF (Mab_3112-Mab_3113) complex
分子名称: BETA-MERCAPTOETHANOL, ESAT-6-like protein MAB_3112, ESAT-6-like protein MAB_3113, ...
著者Arbing, M.A, Chan, S, Lu, J, Kuo, E, Harris, L, Eisenberg, D, Integrated Center for Structure and Function Innovation (ISFI), TB Structural Genomics Consortium (TBSGC)
登録日2012-11-19
公開日2013-01-16
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.956 Å)
主引用文献Heterologous expression of mycobacterial Esx complexes in Escherichia coli for structural studies is facilitated by the use of maltose binding protein fusions.
Plos One, 8, 2013
5HK4
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BU of 5hk4 by Molmil
Structure function studies of R. palustris RubisCO (A47V-M331A mutant)
分子名称: 2-CARBOXYARABINITOL-1,5-DIPHOSPHATE, MAGNESIUM ION, Ribulose bisphosphate carboxylase
著者Arbing, M.A, Shin, A, Cascio, D, Satagopan, S, North, J.A, Tabita, F.R.
登録日2016-01-13
公開日2017-01-18
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Structure function studies of R. palustris RubisCO.
To Be Published
5HQM
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BU of 5hqm by Molmil
Structure function studies of R. palustris RubisCO (R. palustris/R. rubrum chimera)
分子名称: 2-CARBOXYARABINITOL-1,5-DIPHOSPHATE, MAGNESIUM ION, POTASSIUM ION, ...
著者Arbing, M.A, Shin, A, Cascio, D, Satagopan, S, Tabita, F.R.
登録日2016-01-21
公開日2017-01-25
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Structure function studies of R. palustris RubisCO.
To Be Published
2NCX
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BU of 2ncx by Molmil
Solution structure of pseudin-2 isolated from the skin of paradoxical frog, Pseudis paradoxa
分子名称: Pseudin-2
著者Jeon, D, Kim, J, Shin, A, Kim, Y.
登録日2016-04-18
公開日2017-08-30
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Optimum Balance between the Cationicity and Structural Component for Bacterial Cell Selectivity and Anti-inflammatory activities of Pseudin-2 and its Analogs
To be Published
2NCY
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BU of 2ncy by Molmil
Solution structure of pseudin-2 analog (Ps-P)
分子名称: Pseudin-2
著者Jeon, D, Kim, J, Shin, A, Kim, Y.
登録日2016-04-18
公開日2017-04-26
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Optimum Balance between the Cationicity and Structural Component for Bacterial Cell Selectivity and Anti-inflammatory activities of Pseudin-2 and its Analogs
To be Published
7NWK
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BU of 7nwk by Molmil
Crystal structure of CDK9-Cyclin T1 bound by compound 6
分子名称: Cyclin-T1, Cyclin-dependent kinase 9, N-((1R,3R)-3-(7-(4-fluoro-2-methoxyphenyl)-3H-imidazo[4,5-b]pyridin-2-yl)cyclopentyl)acetamide
著者Collie, G.W, Ferguson, A.D.
登録日2021-03-16
公開日2021-10-27
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (2.81 Å)
主引用文献Discovery of a Series of 7-Azaindoles as Potent and Highly Selective CDK9 Inhibitors for Transient Target Engagement.
J.Med.Chem., 64, 2021
5JRF
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BU of 5jrf by Molmil
Crystal structure of the light-driven sodium pump KR2 bound with iodide ions
分子名称: EICOSANE, IODIDE ION, Sodium pumping rhodopsin
著者Melnikov, I, Polovinkin, V, Kovalev, K, Shevchenko, V, Gushchin, I, Popov, A, Gordeliy, V.
登録日2016-05-06
公開日2017-05-31
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Fast iodide-SAD phasing for high-throughput membrane protein structure determination.
Sci Adv, 3, 2017
5JSI
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BU of 5jsi by Molmil
Structure of membrane protein
分子名称: (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, Bacteriorhodopsin, EICOSANE, ...
著者Melnikov, I, Polovinkin, V, Kovalev, K, Shevchenko, V, Gushchin, I, Popov, A, Gordeliy, V.
登録日2016-05-08
公開日2017-05-31
最終更新日2023-03-08
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Fast iodide-SAD phasing for high-throughput membrane protein structure determination.
Sci Adv, 3, 2017
8IMD
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BU of 8imd by Molmil
Crystal structure of Cu/Zn Superoxide dismutase from Paenibacillus lautus
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, COPPER (II) ION, Cu/Zn-Superoxide dismutase, ...
著者Narikiyo, S, Furukawa, Y, Akutsu, M.
登録日2023-03-06
公開日2024-01-17
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献Characterization of a novel cysteine-less Cu/Zn-superoxide dismutase in Paenibacillus lautus missing a conserved disulfide bond.
J.Biol.Chem., 299, 2023
7AVB
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BU of 7avb by Molmil
Solution structure of the fluorogen-activating protein FAST in the apo state
分子名称: FAST
著者Mineev, K.S, Goncharuk, S.A, Baranov, M.S.
登録日2020-11-05
公開日2021-04-28
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献NanoFAST: structure-based design of a small fluorogen-activating protein with only 98 amino acids.
Chem Sci, 12, 2021
7AVA
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BU of 7ava by Molmil
Solution structure of the fluorogen-activating protein FAST in complex with the ligand N871b
分子名称: (5~{Z})-5-[(2-methoxy-4-oxidanyl-phenyl)methylidene]-3-methyl-2-[(~{E})-2-pyridin-4-ylethenyl]imidazol-4-one, FAST
著者Mineev, K.S, Goncharuk, S.A, Baranov, M.S.
登録日2020-11-05
公開日2021-04-28
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献NanoFAST: structure-based design of a small fluorogen-activating protein with only 98 amino acids.
Chem Sci, 12, 2021
6WI6
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BU of 6wi6 by Molmil
Crystal structure of plantacyclin B21AG
分子名称: MALONATE ION, Plantacyclin B21AG
著者Smith, A.T, Gor, M.C, Vezina, B, McMahon, R, King, G, Panjikar, S, Rehm, B, Martin, J.
登録日2020-04-08
公開日2021-01-06
最終更新日2021-02-03
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal structure and site-directed mutagenesis of circular bacteriocin plantacyclin B21AG reveals cationic and aromatic residues important for antimicrobial activity.
Sci Rep, 10, 2020
1GAI
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BU of 1gai by Molmil
GLUCOAMYLASE-471 COMPLEXED WITH D-GLUCO-DIHYDROACARBOSE
分子名称: 4,6-dideoxy-4-{[(1S,2S,3S,4R,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]amino}-alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose, GLUCOAMYLASE-471, alpha-D-mannopyranose, ...
著者Aleshin, A.E, Stoffer, B, Firsov, L.M, Svensson, B, Honzatko, R.B.
登録日1996-03-06
公開日1996-08-17
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Crystallographic complexes of glucoamylase with maltooligosaccharide analogs: relationship of stereochemical distortions at the nonreducing end to the catalytic mechanism.
Biochemistry, 35, 1996
1GAH
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BU of 1gah by Molmil
GLUCOAMYLASE-471 COMPLEXED WITH ACARBOSE
分子名称: 4,6-dideoxy-4-{[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}-alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose, GLUCOAMYLASE-471, alpha-D-mannopyranose, ...
著者Aleshin, A.E, Stoffer, B, Firsov, L.M, Svensson, B, Honzatko, R.B.
登録日1996-03-06
公開日1996-08-17
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Crystallographic complexes of glucoamylase with maltooligosaccharide analogs: relationship of stereochemical distortions at the nonreducing end to the catalytic mechanism.
Biochemistry, 35, 1996
8AMO
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BU of 8amo by Molmil
Crystal structure of M. tuberculosis CYP143
分子名称: CHLORIDE ION, GLYCEROL, PROTOPORPHYRIN IX CONTAINING FE, ...
著者Bukhdruker, S, Varaksa, T, Grudo, A, Marin, E, Kapranov, I, Shevtsov, M, Gilep, A, Strushkevich, N, Borshchevskiy, V.
登録日2022-08-03
公開日2023-02-15
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Structural insights into 3Fe-4S ferredoxins diversity in M. tuberculosis highlighted by a first redox complex with P450.
Front Mol Biosci, 9, 2022
8AMQ
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BU of 8amq by Molmil
Crystal structure of the complex CYP143-FdxE from M. tuberculosis
分子名称: FE3-S4 CLUSTER, NICKEL (II) ION, PROTOPORPHYRIN IX CONTAINING FE, ...
著者Bukhdruker, S, Varaksa, T, Smolskaya, S, Marin, E, Kapranov, I, Kovalev, K, Gilep, A, Strushkevich, N, Borshchevskiy, V.
登録日2022-08-03
公開日2023-02-15
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Structural insights into 3Fe-4S ferredoxins diversity in M. tuberculosis highlighted by a first redox complex with P450.
Front Mol Biosci, 9, 2022
7ZB9
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BU of 7zb9 by Molmil
Crystal structure of CYP124 in complex with inhibitor carbethoxyhexyl imidazole in the absence of glycerol (NoCryo)
分子名称: CHLORIDE ION, CYP124 in complex with inhibitor carbethoxyhexyl imidazole, MAGNESIUM ION, ...
著者Bukhdruker, S, Varaksa, T, Marin, E, Gilep, A, Strushkevich, N, Borshchevskiy, V.
登録日2022-03-23
公開日2023-01-11
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (1.15 Å)
主引用文献Structural insights into the effects of glycerol on ligand binding to cytochrome P450.
Acta Crystallogr D Struct Biol, 79, 2023
8PKY
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BU of 8pky by Molmil
Structure of Chloroflexus aggregans flavin based fluorescent protein (CagFbFP) Q148V variant
分子名称: FLAVIN MONONUCLEOTIDE, histidine kinase
著者Nikolaev, A, Remeeva, A, Gushchin, I.
登録日2023-06-27
公開日2023-07-05
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Two distinct mechanisms of flavoprotein spectral tuning revealed by low-temperature and time-dependent spectroscopy.
Protein Sci., 33, 2024
8PM1
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BU of 8pm1 by Molmil
Structure of Chloroflexus aggregans flavin based fluorescent protein (CagFbFP) variant I52V A85Q
分子名称: FLAVIN MONONUCLEOTIDE, histidine kinase
著者Nikolaev, A, Remeeva, A, Gushchin, I.
登録日2023-06-27
公開日2023-07-05
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Two distinct mechanisms of flavoprotein spectral tuning revealed by low-temperature and time-dependent spectroscopy.
Protein Sci., 33, 2024
6T0L
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BU of 6t0l by Molmil
Crystal structure of CYP124 in complex with inhibitor compound 5'
分子名称: CHLORIDE ION, CYP124 in complex with inhibitor compound 5', DI(HYDROXYETHYL)ETHER, ...
著者Bukhdruker, S, Marin, E, Varaksa, T, Gilep, A, Strushkevich, N, Borshchevskiy, V.
登録日2019-10-03
公開日2020-10-14
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Metabolic Fate of Human Immunoactive Sterols in Mycobacterium tuberculosis.
J.Mol.Biol., 433, 2021

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