3BC3
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![BU of 3bc3 by Molmil](/molmil-images/mine/3bc3) | Exploring inhibitor binding at the S subsites of cathepsin L | 分子名称: | Cathepsin L heavy and light chains, S-benzyl-N-(biphenyl-4-ylacetyl)-L-cysteinyl-N~5~-(diaminomethyl)-D-ornithyl-N-(2-phenylethyl)-L-tyrosinamide | 著者 | Chowdhury, S.F, Joseph, L, Kumar, S, Tulsidas, S.R, Bhat, S, Ziomek, E, Nard, R.M, Sivaraman, J, Purisima, E.O. | 登録日 | 2007-11-12 | 公開日 | 2008-03-18 | 最終更新日 | 2023-08-30 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | Exploring inhibitor binding at the S' subsites of cathepsin L J.Med.Chem., 51, 2008
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6YCB
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![BU of 6ycb by Molmil](/molmil-images/mine/6ycb) | Structure the ananain protease from Ananas comosus covalently bound to with the E64 inhibitor | 分子名称: | Ananain, GLYCEROL, L(+)-TARTARIC ACID, ... | 著者 | Azarkan, M, Charlier, P, Herman, R, Delbrassine, F, Sauvage, E, M Rabet, N, Calvo Esposito, R, Kerff, F. | 登録日 | 2020-03-18 | 公開日 | 2020-11-25 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.257 Å) | 主引用文献 | Structures of the free and inhibitors-bound forms of bromelain and ananain from Ananas comosus stem and in vitro study of their cytotoxicity. Sci Rep, 10, 2020
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6YCD
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![BU of 6ycd by Molmil](/molmil-images/mine/6ycd) | Structure the ananain protease from Ananas comosus covalently bound to the TLCK inhibitor | 分子名称: | Ananain, GLYCEROL, N-[(1S)-5-amino-1-(chloroacetyl)pentyl]-4-methylbenzenesulfonamide, ... | 著者 | Azarkan, M, Charlier, P, Herman, R, Delbrassine, F, Sauvage, E, M Rabet, N, Calvo Esposito, R, Kerff, F. | 登録日 | 2020-03-18 | 公開日 | 2020-11-25 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.35 Å) | 主引用文献 | Structures of the free and inhibitors-bound forms of bromelain and ananain from Ananas comosus stem and in vitro study of their cytotoxicity. Sci Rep, 10, 2020
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6YCG
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![BU of 6ycg by Molmil](/molmil-images/mine/6ycg) | Structure the bromelain protease from Ananas comosus in complex with the TLCK inhibitor | 分子名称: | CITRIC ACID, FBSB, ISOPROPYL ALCOHOL, ... | 著者 | Azarkan, M, Charlier, P, Herman, R, Delbrassine, F, Sauvage, E, M Rabet, N, Calvo Esposito, R, Kerff, F. | 登録日 | 2020-03-18 | 公開日 | 2020-11-25 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.45 Å) | 主引用文献 | Structures of the free and inhibitors-bound forms of bromelain and ananain from Ananas comosus stem and in vitro study of their cytotoxicity. Sci Rep, 10, 2020
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3BPM
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![BU of 3bpm by Molmil](/molmil-images/mine/3bpm) | Crystal Structure of Falcipain-3 with Its inhibitor, Leupeptin | 分子名称: | Cysteine protease falcipain-3, Leupeptin, SULFATE ION | 著者 | kerr, I.D, Lee, J.H, Brinen, L.S. | 登録日 | 2007-12-18 | 公開日 | 2008-12-30 | 最終更新日 | 2023-08-30 | 実験手法 | X-RAY DIFFRACTION (2.5 Å) | 主引用文献 | Structures of falcipain-2 and falcipain-3 bound to small molecule inhibitors: implications for substrate specificity. J.Med.Chem., 52, 2009
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6ZQ3
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![BU of 6zq3 by Molmil](/molmil-images/mine/6zq3) | |
8CD9
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![BU of 8cd9 by Molmil](/molmil-images/mine/8cd9) | Cathepsin B1 from Schistosoma mansoni in complex with gallinamide analog 6 | 分子名称: | 1,2-ETHANEDIOL, Cathepsin B-like peptidase (C01 family), SODIUM ION, ... | 著者 | Rubesova, P, Brynda, J, Fanfrlik, J, Gerwick, W.H, Mares, M. | 登録日 | 2023-01-30 | 公開日 | 2024-02-21 | 実験手法 | X-RAY DIFFRACTION (1.55 Å) | 主引用文献 | Cathepsin B1 from Schistosoma mansoni in complex with gallinamide analog 6 To Be Published
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8C77
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![BU of 8c77 by Molmil](/molmil-images/mine/8c77) | Human cathepsin L after reaction with the thiocarbazate inhibitor CID 16725315 | 分子名称: | 1,2-ETHANEDIOL, ACETATE ION, Cathepsin L, ... | 著者 | Falke, S, Lieske, J, Guenther, S, Reinke, P.Y.A, Ewert, W, Loboda, J, Karnicar, K, Usenik, A, Lindic, N, Sekirnik, A, Chapman, H.N, Hinrichs, W, Turk, D, Meents, A. | 登録日 | 2023-01-12 | 公開日 | 2023-01-25 | 最終更新日 | 2024-05-22 | 実験手法 | X-RAY DIFFRACTION (1.7 Å) | 主引用文献 | Structural Elucidation and Antiviral Activity of Covalent Cathepsin L Inhibitors. J.Med.Chem., 67, 2024
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3BPF
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![BU of 3bpf by Molmil](/molmil-images/mine/3bpf) | Crystal Structure of Falcipain-2 with Its inhibitor, E64 | 分子名称: | Cysteine protease falcipain-2, GLYCEROL, N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-BUTYL]-GUANIDINE | 著者 | kerr, I.D, Lee, J.H, Brinen, L.S. | 登録日 | 2007-12-18 | 公開日 | 2008-12-30 | 最終更新日 | 2023-08-30 | 実験手法 | X-RAY DIFFRACTION (2.9 Å) | 主引用文献 | Structures of falcipain-2 and falcipain-3 bound to small molecule inhibitors: implications for substrate specificity. J.Med.Chem., 52, 2009
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3BWK
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![BU of 3bwk by Molmil](/molmil-images/mine/3bwk) | Crystal Structure of Falcipain-3 with Its inhibitor, K11017 | 分子名称: | Cysteine protease falcipain-3, N~2~-(morpholin-4-ylcarbonyl)-N-[(3S)-1-phenyl-5-(phenylsulfonyl)pentan-3-yl]-L-leucinamide, SULFATE ION | 著者 | Kerr, I, Lee, J.H, Brinen, L.S. | 登録日 | 2008-01-09 | 公開日 | 2009-01-20 | 最終更新日 | 2023-08-30 | 実験手法 | X-RAY DIFFRACTION (2.42 Å) | 主引用文献 | Vinyl sulfones as antiparasitic agents and a structural basis for drug design. J.Biol.Chem., 284, 2009
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3AI8
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![BU of 3ai8 by Molmil](/molmil-images/mine/3ai8) | Cathepsin B in complex with the nitroxoline | 分子名称: | 5-nitroquinolin-8-ol, Cathepsin B | 著者 | Renko, M, Mirkovic, B, Gobec, S, Kos, J, Turk, D. | 登録日 | 2010-05-11 | 公開日 | 2011-05-18 | 最終更新日 | 2023-11-01 | 実験手法 | X-RAY DIFFRACTION (2.11 Å) | 主引用文献 | Novel mechanism of cathepsin B inhibition by antibiotic nitroxoline and related compounds Chemmedchem, 6, 2011
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3CH3
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![BU of 3ch3 by Molmil](/molmil-images/mine/3ch3) | Crystal Structure Analysis of SERA5E from plasmodium falciparum | 分子名称: | DIHYDROGENPHOSPHATE ION, POTASSIUM ION, Serine-repeat antigen protein | 著者 | Smith, B.J, Malby, R.L, Colman, P.M, Clarke, O.B. | 登録日 | 2008-03-07 | 公開日 | 2008-03-25 | 最終更新日 | 2017-10-25 | 実験手法 | X-RAY DIFFRACTION (1.79 Å) | 主引用文献 | Structural Insights into the Protease-like Antigen Plasmodium falciparum SERA5 and Its Noncanonical Active-Site Serine J.Mol.Biol., 392, 2009
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3CH2
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![BU of 3ch2 by Molmil](/molmil-images/mine/3ch2) | Crystal Structure Analysis of SERA5E from plasmodium falciparum | 分子名称: | CALCIUM ION, Serine-repeat antigen protein | 著者 | Smith, B.J, Malby, R.L, Colman, P.M, Clarke, O.B. | 登録日 | 2008-03-07 | 公開日 | 2008-03-25 | 最終更新日 | 2023-11-01 | 実験手法 | X-RAY DIFFRACTION (1.8 Å) | 主引用文献 | Structural Insights into the Protease-like Antigen Plasmodium falciparum SERA5 and Its Noncanonical Active-Site Serine J.Mol.Biol., 392, 2009
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3IOQ
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![BU of 3ioq by Molmil](/molmil-images/mine/3ioq) | Crystal structure of the Carica candamarcensis cysteine protease CMS1MS2 in complex with E-64. | 分子名称: | 1,2-ETHANEDIOL, CMS1MS2, N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-BUTYL]-GUANIDINE, ... | 著者 | Gomes, M.T.R, Teixeira, R.D, Salas, C.E, Nagem, R.A.P. | 登録日 | 2009-08-14 | 公開日 | 2010-02-16 | 最終更新日 | 2023-09-06 | 実験手法 | X-RAY DIFFRACTION (1.87 Å) | 主引用文献 | Crystal structure of the Carica candamarcensis cysteine protease CMS1MS2 in complex with E-64 To be Published
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3IV2
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![BU of 3iv2 by Molmil](/molmil-images/mine/3iv2) | Crystal structure of mature apo-Cathepsin L C25A mutant | 分子名称: | 2-acetamido-2-deoxy-beta-D-glucopyranose, Cathepsin L1, GLYCEROL, ... | 著者 | Adams-Cioaba, M.A, Krupa, J.C, Mort, J.S, Bountra, C, Weigelt, J, Arrowsmith, C.H, Edwards, A.M, Bochkarev, A, Min, J. | 登録日 | 2009-08-31 | 公開日 | 2010-03-23 | 最終更新日 | 2021-10-13 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | Structural basis for the recognition and cleavage of histone H3 by cathepsin L. Nat Commun, 2, 2011
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3IEJ
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![BU of 3iej by Molmil](/molmil-images/mine/3iej) | |
3IUT
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![BU of 3iut by Molmil](/molmil-images/mine/3iut) | The Crystal Structure of Cruzain in Complex with a Tetrafluorophenoxymethyl Ketone Inhibitor | 分子名称: | (3S)-3-(4-{(1S)-1,2-dimethyl-1-[(quinolin-6-ylmethyl)amino]propyl}-1H-1,2,3-triazol-1-yl)heptan-2-one, 1,2-ETHANEDIOL, Cruzipain | 著者 | Kerr, I.D, Debnath, M, Brinen, L.S. | 登録日 | 2009-08-31 | 公開日 | 2010-03-02 | 最終更新日 | 2023-09-06 | 実験手法 | X-RAY DIFFRACTION (1.2 Å) | 主引用文献 | Nonpeptidic tetrafluorophenoxymethyl ketone cruzain inhibitors as promising new leads for chagas disease chemotherapy. J.Med.Chem., 53, 2010
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3KKU
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![BU of 3kku by Molmil](/molmil-images/mine/3kku) | Cruzain in complex with a non-covalent ligand | 分子名称: | 1,2-ETHANEDIOL, Cruzipain, N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-bromophenoxy)acetamide, ... | 著者 | Ferreira, R.S, Eidam, O, Shoichet, B.K. | 登録日 | 2009-11-06 | 公開日 | 2010-07-07 | 最終更新日 | 2023-09-06 | 実験手法 | X-RAY DIFFRACTION (1.28 Å) | 主引用文献 | Complementarity between a docking and a high-throughput screen in discovering new cruzain inhibitors. J.Med.Chem., 53, 2010
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3K24
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![BU of 3k24 by Molmil](/molmil-images/mine/3k24) | Crystal structure of mature apo-Cathepsin L C25A mutant in complex with Gln-Leu-Ala peptide | 分子名称: | 2-acetamido-2-deoxy-alpha-D-glucopyranose-(1-6)-beta-D-mannopyranose-(1-6)-[alpha-D-mannopyranose-(1-2)]alpha-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-alpha-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose, Cathepsin L1, ... | 著者 | Adams-Cioaba, M.A, Krupa, J.C, Mort, J.S, Bountra, C, Weigelt, J, Arrowsmith, C.H, Edwards, A.M, Bochkarev, A, Min, J, Structural Genomics Consortium (SGC) | 登録日 | 2009-09-29 | 公開日 | 2010-03-23 | 最終更新日 | 2023-09-06 | 実験手法 | X-RAY DIFFRACTION (2.5 Å) | 主引用文献 | Structural basis for the recognition and cleavage of histone H3 by cathepsin L. Nat Commun, 2, 2011
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3KX1
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3I06
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![BU of 3i06 by Molmil](/molmil-images/mine/3i06) | Crystal structure of cruzain covalently bound to a purine nitrile | 分子名称: | 6-[(3,5-difluorophenyl)amino]-9-ethyl-9H-purine-2-carbonitrile, Cruzipain | 著者 | Ferreira, R.S, Shoichet, B.K, McKerrow, J.H. | 登録日 | 2009-06-24 | 公開日 | 2009-12-15 | 最終更新日 | 2023-09-06 | 実験手法 | X-RAY DIFFRACTION (1.1 Å) | 主引用文献 | Identification and optimization of inhibitors of trypanosomal cysteine proteases: cruzain, rhodesain, and TbCatB. J.Med.Chem., 53, 2010
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3LXS
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![BU of 3lxs by Molmil](/molmil-images/mine/3lxs) | |
3LFY
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![BU of 3lfy by Molmil](/molmil-images/mine/3lfy) | CTD of Tarocystatin in complex with papain | 分子名称: | ASPARAGINE, GLYCINE, Papain, ... | 著者 | Chu, M.H, Liu, K.L, Yeh, K.W, Cheng, Y.S. | 登録日 | 2010-01-19 | 公開日 | 2010-07-21 | 最終更新日 | 2023-11-22 | 実験手法 | X-RAY DIFFRACTION (2.6 Å) | 主引用文献 | Crystal structure of tarocystatin-papain complex: implications for the inhibition property of group-2 phytocystatins. Planta, 234, 2011
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3HWN
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![BU of 3hwn by Molmil](/molmil-images/mine/3hwn) | CATHEPSIN L with AZ13010160 | 分子名称: | Cathepsin L1, Nalpha-[(3-tert-butyl-1-methyl-1H-pyrazol-5-yl)carbonyl]-N-[(2E)-2-iminoethyl]-3-{5-[(Z)-iminomethyl]-1,3,4-oxadiazol-2-yl}-L-phenylalaninamide | 著者 | Kenny, P, Morley, A. | 登録日 | 2009-06-18 | 公開日 | 2009-09-15 | 最終更新日 | 2021-10-13 | 実験手法 | X-RAY DIFFRACTION (2.33 Å) | 主引用文献 | Design of selective Cathepsin inhibitors Bioorg.Med.Chem.Lett., 19, 2009
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3KWB
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![BU of 3kwb by Molmil](/molmil-images/mine/3kwb) | Structure of CatK covalently bound to a dioxo-triazine inhibitor | 分子名称: | 3,5-dioxo-4-(3-piperidin-1-ylpropyl)-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile, Cathepsin K | 著者 | Uitdehaag, J.C.M, van Zeeland, M. | 登録日 | 2009-12-01 | 公開日 | 2010-04-07 | 最終更新日 | 2011-07-13 | 実験手法 | X-RAY DIFFRACTION (2.02 Å) | 主引用文献 | Dioxo-triazines as a novel series of cathepsin K inhibitors Bioorg.Med.Chem.Lett., 20, 2010
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