1EWX
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![BU of 1ewx by Molmil](/molmil-images/mine/1ewx) | Crystal structure of native tryparedoxin I from Crithidia fasciculata | Descriptor: | TRYPAREDOXIN I | Authors: | Hofmann, B, Guerrero, S.A, Kalisz, H.M, Menge, U, Nogoceke, E, Montemartini, M, Singh, M, Flohe, L, Hecht, H.J. | Deposit date: | 2000-04-28 | Release date: | 2000-05-10 | Last modified: | 2011-07-13 | Method: | X-RAY DIFFRACTION (1.7 Å) | Cite: | Structures of tryparedoxins revealing interaction with trypanothione. Biol.Chem., 382, 2001
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1EZK
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![BU of 1ezk by Molmil](/molmil-images/mine/1ezk) | Crystal structure of recombinant tryparedoxin I | Descriptor: | TRYPAREDOXIN I | Authors: | Hofmann, B, Guerrero, S.A, Kalisz, H.M, Menge, U, Nogoceke, E, Montemartini, M, Singh, M, Flohe, L, Hecht, H.J. | Deposit date: | 2000-05-11 | Release date: | 2000-05-24 | Last modified: | 2011-07-13 | Method: | X-RAY DIFFRACTION (1.9 Å) | Cite: | Structures of tryparedoxins revealing interaction with trypanothione. Biol.Chem., 382, 2001
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2N6J
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![BU of 2n6j by Molmil](/molmil-images/mine/2n6j) | Solution structure of Zmp1, a zinc-dependent metalloprotease secreted by Clostridium difficile | Descriptor: | ZINC ION, Zinc metalloprotease Zmp1 | Authors: | Banci, L, Cantini, F, Scarselli, M, Rubino, J.T, Martinelli, M. | Deposit date: | 2015-08-24 | Release date: | 2016-01-13 | Last modified: | 2024-05-01 | Method: | SOLUTION NMR | Cite: | Structural characterization of zinc-bound Zmp1, a zinc-dependent metalloprotease secreted by Clostridium difficile. J.Biol.Inorg.Chem., 21, 2016
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4TR2
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![BU of 4tr2 by Molmil](/molmil-images/mine/4tr2) | Crystal structure of PvSUB1 | Descriptor: | CALCIUM ION, PHOSPHATE ION, Subtilisin-like 1 serine protease | Authors: | Giganti, D, Bouillon, A, Martinez, M, Weber, P, Girard-Blanc, C, Petres, S, Haouz, A, Barale, J.C, Alzari, P.M. | Deposit date: | 2014-06-13 | Release date: | 2014-09-17 | Last modified: | 2023-12-20 | Method: | X-RAY DIFFRACTION (2.7 Å) | Cite: | A novel Plasmodium-specific prodomain fold regulates the malaria drug target SUB1 subtilase. Nat Commun, 5, 2014
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3QKK
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![BU of 3qkk by Molmil](/molmil-images/mine/3qkk) | Spirochromane Akt Inhibitors | Descriptor: | GSK-3 beta peptide, N-(2-ethoxyethyl)-N-{(2S)-2-hydroxy-3-[(2R)-6-hydroxy-4-oxo-3,4-dihydro-1'H-spiro[chromene-2,3'-piperidin]-1'-yl]propyl}-2,6-dimethylbenzenesulfonamide, RAC-alpha serine/threonine-protein kinase | Authors: | Kallan, N.C, Spencer, K.L, Blake, J.F, Xu, R, Heizer, J, Bencsik, J.R, Mitchell, I.S, Gloor, S.L, Martinson, M, Risom, T, Gross, S.D, Morales, T, Vigers, G.P.A, Brandhuber, B.J, Skelton, N.J. | Deposit date: | 2011-02-01 | Release date: | 2011-03-30 | Last modified: | 2011-07-13 | Method: | X-RAY DIFFRACTION (2.3 Å) | Cite: | Discovery and SAR of spirochromane Akt inhibitors. Bioorg.Med.Chem.Lett., 21, 2011
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3QKM
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![BU of 3qkm by Molmil](/molmil-images/mine/3qkm) | Spirocyclic sulfonamides as AKT inhibitors | Descriptor: | N-(2-ethoxyethyl)-N-{(2S)-2-hydroxy-3-[(5R)-2-(quinazolin-4-yl)-2,7-diazaspiro[4.5]dec-7-yl]propyl}-2,6-dimethylbenzenesulfonamide, RAC-alpha serine/threonine-protein kinase | Authors: | Xu, R, Banka, A, Blake, J.F, Mitchell, I.S, Wallace, E.M, Gloor, S.L, Martinson, M, Risom, T, Gross, S.D, Morales, T, Vigers, G.P.A, Brandhuber, B.J, Skelton, N.J. | Deposit date: | 2011-02-01 | Release date: | 2011-04-06 | Last modified: | 2011-07-13 | Method: | X-RAY DIFFRACTION (2.2 Å) | Cite: | Discovery of spirocyclic sulfonamides as potent Akt inhibitors with exquisite selectivity against PKA. Bioorg.Med.Chem.Lett., 21, 2011
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1I5G
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![BU of 1i5g by Molmil](/molmil-images/mine/1i5g) | TRYPAREDOXIN II COMPLEXED WITH GLUTATHIONYLSPERMIDINE | Descriptor: | 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, GLUTATHIONYLSPERMIDINE, TRYPAREDOXIN II | Authors: | Hofmann, B, Budde, H, Bruns, K, Guerrero, S.A, Kalisz, H.M, Menge, U, Montemartini, M, Nogoceke, E, Steinert, P, Wissing, J.B, Flohe, L, Hecht, H.-J. | Deposit date: | 2001-02-27 | Release date: | 2001-03-14 | Last modified: | 2023-08-09 | Method: | X-RAY DIFFRACTION (1.4 Å) | Cite: | Structures of tryparedoxins revealing interaction with trypanothione. Biol.Chem., 382, 2001
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3QKL
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![BU of 3qkl by Molmil](/molmil-images/mine/3qkl) | Spirochromane Akt Inhibitors | Descriptor: | GSK-3 beta peptide, N-{(2S)-3-[(3S)-8',9'-dihydro-1H,3'H-spiro[piperidine-3,7'-pyrano[3,2-e]indazol]-1-yl]-2-hydroxypropyl}-N-(2-ethoxyethyl)-2,6-dimethylbenzenesulfonamide, RAC-alpha serine/threonine-protein kinase | Authors: | Kallan, N.C, Spencer, K.L, Blake, J.F, Xu, R, Heizer, J, Bencsik, J.R, Mitchell, I.S, Gloor, S.L, Martinson, M, Risom, T, Gross, S.D, Morales, T, Vigers, G.P.A, Brandhuber, B.J, Skelton, N.J. | Deposit date: | 2011-02-01 | Release date: | 2011-03-30 | Last modified: | 2011-07-13 | Method: | X-RAY DIFFRACTION (1.9 Å) | Cite: | Discovery and SAR of spirochromane Akt inhibitors. Bioorg.Med.Chem.Lett., 21, 2011
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8B2D
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![BU of 8b2d by Molmil](/molmil-images/mine/8b2d) | CRYSTAL STRUCTURE OF BACTERIAL FLAVIN CONTAINING MONOOXYGENASE THERMORESISTANT MUTANT, IN COMPLEX WITH NADP+ | Descriptor: | 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CHLORIDE ION, FLAVIN-ADENINE DINUCLEOTIDE, ... | Authors: | Cea-Rama, I, Sanz-Aparicio, J, Ferrer Martinez, M, Goris, M, Bjerga, G. | Deposit date: | 2022-09-13 | Release date: | 2023-06-14 | Last modified: | 2024-02-07 | Method: | X-RAY DIFFRACTION (1.62 Å) | Cite: | Increased Thermostability of an Engineered Flavin-Containing Monooxygenase to Remediate Trimethylamine in Fish Protein Hydrolysates. Appl.Environ.Microbiol., 89, 2023
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2RLI
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![BU of 2rli by Molmil](/molmil-images/mine/2rli) | Solution structure of Cu(I) human Sco2 | Descriptor: | COPPER (I) ION, SCO2 protein homolog, mitochondrial | Authors: | Banci, L, Bertini, I, Ciofi-baffoni, S, Gerothanassis, I.P, Leontari, I, Martinelli, M, Wang, S, Structural Proteomics in Europe (SPINE), Structural Proteomics in Europe 2 (SPINE-2) | Deposit date: | 2007-07-11 | Release date: | 2007-08-28 | Last modified: | 2024-05-29 | Method: | SOLUTION NMR | Cite: | A Structural Characterization of Human SCO2 Structure, 15, 2007
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2RN9
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![BU of 2rn9 by Molmil](/molmil-images/mine/2rn9) | Solution structure of human apoCox17 | Descriptor: | Cytochrome c oxidase copper chaperone | Authors: | Banci, L, Bertini, I, Ciofi-Baffoni, S, Janicka, A, Martinelli, M, Kozlowski, H, Palumaa, P. | Deposit date: | 2007-12-08 | Release date: | 2007-12-18 | Last modified: | 2023-06-14 | Method: | SOLUTION NMR | Cite: | A structural-dynamical characterization of human cox17 J.Biol.Chem., 283, 2008
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2RNB
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![BU of 2rnb by Molmil](/molmil-images/mine/2rnb) | Solution structure of human Cu(I)Cox17 | Descriptor: | COPPER (I) ION, Cytochrome c oxidase copper chaperone | Authors: | Banci, L, Bertini, I, Ciofi-Baffoni, S, Janicka, A, Martinelli, M, Kozlowski, H, Palumaa, P. | Deposit date: | 2007-12-08 | Release date: | 2007-12-18 | Last modified: | 2023-06-14 | Method: | SOLUTION NMR | Cite: | A structural-dynamical characterization of human cox17 J.Biol.Chem., 283, 2008
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2GQL
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![BU of 2gql by Molmil](/molmil-images/mine/2gql) | Solution structure of Human Ni(II)-Sco1 | Descriptor: | NICKEL (II) ION, SCO1 protein homolog, mitochondrial | Authors: | Banci, L, Bertini, I, Calderone, V, Ciofi-Baffoni, S, Mangani, S, Palumaa, P, Martinelli, M, Wang, S, Structural Proteomics in Europe (SPINE) | Deposit date: | 2006-04-21 | Release date: | 2006-06-06 | Last modified: | 2024-05-29 | Method: | SOLUTION NMR | Cite: | A hint for the function of human Sco1 from different structures. Proc.Natl.Acad.Sci.Usa, 103, 2006
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2GT6
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![BU of 2gt6 by Molmil](/molmil-images/mine/2gt6) | Solution structure of Human Cu(I) Sco1 | Descriptor: | COPPER (I) ION, SCO1 protein homolog, mitochondrial | Authors: | Banci, L, Bertini, I, Calderone, V, Ciofi-Baffoni, S, Mangani, S, Palumaa, P, Martinelli, M, Wang, S, Structural Proteomics in Europe (SPINE) | Deposit date: | 2006-04-27 | Release date: | 2006-06-06 | Last modified: | 2024-05-29 | Method: | SOLUTION NMR | Cite: | A hint for the function of human Sco1 from different structures. Proc.Natl.Acad.Sci.Usa, 103, 2006
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2GGT
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![BU of 2ggt by Molmil](/molmil-images/mine/2ggt) | Crystal structure of human SCO1 complexed with nickel. | Descriptor: | CHLORIDE ION, NICKEL (II) ION, SCO1 protein homolog, ... | Authors: | Banci, L, Bertini, I, Calderone, V, Ciofi-Baffoni, S, Mangani, S, Martinelli, M, Palumaa, P, Wang, S. | Deposit date: | 2006-03-24 | Release date: | 2006-05-16 | Last modified: | 2023-08-30 | Method: | X-RAY DIFFRACTION (2.4 Å) | Cite: | A hint for the function of human Sco1 from different structures. Proc.Natl.Acad.Sci.Usa, 103, 2006
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2HRF
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![BU of 2hrf by Molmil](/molmil-images/mine/2hrf) | Solution Structure of Cu(I) P174L HSco1 | Descriptor: | COPPER (I) ION, SCO1 protein homolog, mitochondrial | Authors: | Banci, L, Bertini, I, Ciofi-Baffoni, S, Leontari, I, Martinelli, M, Palumaa, P, Sillard, R, Wang, S, Structural Proteomics in Europe (SPINE) | Deposit date: | 2006-07-20 | Release date: | 2007-01-16 | Last modified: | 2024-05-29 | Method: | SOLUTION NMR | Cite: | Human Sco1 functional studies and pathological implications of the P174L mutant. Proc.Natl.Acad.Sci.Usa, 104, 2007
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2HRN
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![BU of 2hrn by Molmil](/molmil-images/mine/2hrn) | Solution Structure of Cu(I) P174L-HSco1 | Descriptor: | COPPER (I) ION, SCO1 protein homolog, mitochondrial | Authors: | Banci, L, Bertini, I, Ciofi-Baffoni, S, Leontari, I, Martinelli, M, Palumaa, P, Sillard, R, Wang, S, Structural Proteomics in Europe (SPINE) | Deposit date: | 2006-07-20 | Release date: | 2007-01-16 | Last modified: | 2024-05-29 | Method: | SOLUTION NMR | Cite: | Human Sco1 functional studies and pathological implications of the P174L mutant. Proc.Natl.Acad.Sci.Usa, 104, 2007
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2GQK
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![BU of 2gqk by Molmil](/molmil-images/mine/2gqk) | Solution structure of Human Ni(II)-Sco1 | Descriptor: | NICKEL (II) ION, SCO1 protein homolog, mitochondrial | Authors: | Banci, L, Bertini, I, Calderone, V, Ciofi-Baffoni, S, Mangani, S, Palumaa, P, Martinelli, M, Wang, S, Structural Proteomics in Europe (SPINE) | Deposit date: | 2006-04-21 | Release date: | 2006-06-06 | Last modified: | 2024-05-29 | Method: | SOLUTION NMR | Cite: | A hint for the function of human Sco1 from different structures. Proc.Natl.Acad.Sci.Usa, 103, 2006
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2GVP
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![BU of 2gvp by Molmil](/molmil-images/mine/2gvp) | Solution structure of Human apo Sco1 | Descriptor: | SCO1 protein homolog, mitochondrial | Authors: | Banci, L, Bertini, I, Calderone, V, Ciofi-Baffoni, S, Mangani, S, Paulmaa, P, Martinelli, M, Wang, S, Structural Proteomics in Europe (SPINE) | Deposit date: | 2006-05-03 | Release date: | 2006-06-06 | Last modified: | 2024-05-29 | Method: | SOLUTION NMR | Cite: | A hint for the function of human Sco1 from different structures. Proc.Natl.Acad.Sci.Usa, 103, 2006
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2GT5
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![BU of 2gt5 by Molmil](/molmil-images/mine/2gt5) | Solution structure of apo Human Sco1 | Descriptor: | SCO1 protein homolog, mitochondrial | Authors: | Banci, L, Bertini, I, Calderone, V, Ciofi-Baffoni, S, Mangani, S, Palumaa, P, Martinelli, M, Wang, S, Structural Proteomics in Europe (SPINE) | Deposit date: | 2006-04-27 | Release date: | 2006-06-06 | Last modified: | 2024-05-29 | Method: | SOLUTION NMR | Cite: | A hint for the function of human Sco1 from different structures. Proc.Natl.Acad.Sci.Usa, 103, 2006
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2GQM
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![BU of 2gqm by Molmil](/molmil-images/mine/2gqm) | Solution structure of Human Cu(I)-Sco1 | Descriptor: | COPPER (I) ION, SCO1 protein homolog, mitochondrial | Authors: | Banci, L, Bertini, I, Calderone, V, Ciofi-Baffoni, S, Mangani, S, Palumaa, P, Martinelli, M, Wang, S, Structural Proteomics in Europe (SPINE) | Deposit date: | 2006-04-21 | Release date: | 2006-06-06 | Last modified: | 2024-05-29 | Method: | SOLUTION NMR | Cite: | A hint for the function of human Sco1 from different structures. Proc.Natl.Acad.Sci.Usa, 103, 2006
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5OHE
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![BU of 5ohe by Molmil](/molmil-images/mine/5ohe) | Globin sensor domain of AfGcHK (FeIII form) in complex with cyanide | Descriptor: | CHLORIDE ION, CYANIDE ION, Globin-coupled histidine kinase, ... | Authors: | Skalova, T, Kolenko, P, Dohnalek, J, Stranava, M, Martinkova, M. | Deposit date: | 2017-07-16 | Release date: | 2017-11-08 | Last modified: | 2024-01-17 | Method: | X-RAY DIFFRACTION (1.85 Å) | Cite: | Coordination and redox state-dependent structural changes of the heme-based oxygen sensor AfGcHK associated with intraprotein signal transduction. J. Biol. Chem., 292, 2017
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5OHF
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![BU of 5ohf by Molmil](/molmil-images/mine/5ohf) | Globin sensor domain of AfGcHK (FeIII form) in complex with cyanide, partially reduced | Descriptor: | CHLORIDE ION, CYANIDE ION, Globin-coupled histidine kinase, ... | Authors: | Skalova, T, Kolenko, P, Dohnalek, J, Stranava, M, Martinkova, M. | Deposit date: | 2017-07-16 | Release date: | 2017-11-08 | Last modified: | 2024-01-17 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | Coordination and redox state-dependent structural changes of the heme-based oxygen sensor AfGcHK associated with intraprotein signal transduction. J. Biol. Chem., 292, 2017
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4DMW
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![BU of 4dmw by Molmil](/molmil-images/mine/4dmw) | Crystal structure of the GT domain of Clostridium difficile toxin A (TcdA) in complex with UDP and Manganese | Descriptor: | MANGANESE (II) ION, Toxin A, URIDINE-5'-DIPHOSPHATE | Authors: | Malito, E, D'Urzo, N, Bottomley, M.J, Biancucci, M, Scarselli, M, Maione, D, Martinelli, M. | Deposit date: | 2012-02-08 | Release date: | 2012-07-18 | Last modified: | 2023-09-13 | Method: | X-RAY DIFFRACTION (2.5 Å) | Cite: | The structure of Clostridium difficile toxin A glucosyltransferase domain bound to Mn2+ and UDP provides insights into glucosyltransferase activity and product release. Febs J., 279, 2012
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4DMV
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![BU of 4dmv by Molmil](/molmil-images/mine/4dmv) | Crystal structure of the GT domain of Clostridium difficile Toxin A | Descriptor: | Toxin A | Authors: | Malito, E, D'Urzo, N, Bottomley, M.J, Biancucci, M, Maione, D, Scarselli, M, Martinelli, M. | Deposit date: | 2012-02-08 | Release date: | 2012-07-18 | Last modified: | 2023-09-13 | Method: | X-RAY DIFFRACTION (1.5 Å) | Cite: | The structure of Clostridium difficile toxin A glucosyltransferase domain bound to Mn2+ and UDP provides insights into glucosyltransferase activity and product release. Febs J., 279, 2012
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