Author results

3BOA
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CRYSTAL STRUCTURE OF YEAST PROTEIN DISULFIDE ISOMERASE.
分子名称:Protein disulfide-isomerase
著者Tian, G., Lennarz, W.J., Schindelin, H.
登録日2007-12-17
公開日2008-09-23
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (3.7 Å)
主引用文献The Catalytic Activity of Protein-disulfide Isomerase Requires a Conformationally Flexible Molecule.
J.Biol.Chem., 283, 2008
2B5E
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CRYSTAL STRUCTURE OF YEAST PROTEIN DISULFIDE ISOMERASE
分子名称:Protein disulfide-isomerase, BARIUM ION, GLYCEROL
著者Schindelin, H., Tian, G.
登録日2005-09-28
公開日2006-01-24
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献The crystal structure of yeast protein disulfide isomerase suggests cooperativity between its active sites.
Cell(Cambridge,Mass.), 124, 2006
2VA5
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X-RAY CRYSTAL STRUCTURE OF BETA SECRETASE COMPLEXED WITH COMPOUND 8C
分子名称:BETA-SECRETASE 1 ., IODIDE ION, 2-amino-6-[2-(1H-indol-6-yl)ethyl]pyrimidin-4(3H)-one
著者Edwards, P.D., Albert, J.S., Sylvester, M., Aharony, D., Andisik, D., Callaghan, O., Campbell, J.B., Carr, R.A., Chessari, G., Congreve, M., Frederickson, M., Folmer, R.H.A., Geschwindner, S., Koether, G., Kolmodin, K., Krumrine, J., Mauger, R.C., Murray, C.W., Olsson, L., Patel, S., Spear, N., Tian, G.
登録日2007-08-30
公開日2007-11-13
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.75 Å)
主引用文献Application of Fragment-Based Lead Generation to the Discovery of Novel, Cyclic Amidine Beta-Secretase Inhibitors with Nanomolar Potency, Cellular Activity, and High Ligand Efficiency.
J.Med.Chem., 50, 2007
2VA6
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X-RAY CRYSTAL STRUCTURE OF BETA SECRETASE COMPLEXED WITH COMPOUND 24
分子名称:BETA SECRETASE 1, IODIDE ION, (6S)-2-amino-6-(3'-methoxybiphenyl-3-yl)-3,6-dimethyl-5,6-dihydropyrimidin-4(3H)-one
著者Edwards, P.D., Albert, J.S., Sylvester, M., Aharony, D., Andisik, D., Callaghan, O., Campbell, J.B., Carr, R.A., Chessari, G., Congreve, M., Frederickson, M., Folmer, R.H.A., Geschwindner, S., Koether, G., Kolmodin, K., Krumrine, J., Mauger, R.C., Murray, C.W., Olsson, L.L., Patel, S., Spear, N., Tian, G.
登録日2007-08-30
公開日2007-11-13
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Application of Fragment-Based Lead Generation to the Discovery of Novel, Cyclic Amidine Beta-Secretase Inhibitors with Nanomolar Potency, Cellular Activity, and High Ligand Efficiency.
J.Med.Chem., 50, 2007
2VA7
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X-RAY CRYSTAL STRUCTURE OF BETA SECRETASE COMPLEXED WITH COMPOUND 27
分子名称:BETA-SECRETASE 1 ., IODIDE ION, (6R)-2-amino-6-[2-(3'-methoxybiphenyl-3-yl)ethyl]-3,6-dimethyl-5,6-dihydropyrimidin-4(3H)-one
著者Edwards, P.D., Albert, J.S., Sylvester, M., Aharony, D., Andisik, D., Callaghan, O., Campbell, J.B., Carr, R.A., Chessari, G., Congreve, M., Frederickson, M., Folmer, R.H.A., Geschwindner, S., Koether, G., Kolmodin, K., Krumrine, J., Mauger, R.C., Murray, C.W., Olsson, L.L., Patel, S., Spear, N., Tian, G.
登録日2007-08-30
公開日2007-11-13
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Application of Fragment-Based Lead Generation to the Discovery of Novel, Cyclic Amidine Beta-Secretase Inhibitors with Nanomolar Potency, Cellular Activity, and High Ligand Efficiency.
J.Med.Chem., 50, 2007
3H43
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N-TERMINAL DOMAIN OF THE PROTEASOME-ACTIVATING NUCLEOTIDASE OF METHANOCALDOCOCCUS JANNASCHII
分子名称:Proteasome-activating nucleotidase
著者Jeffrey, P.D., Zhang, F., Hu, M., Tian, G., Zhang, P., Finley, D., Shi, Y.
登録日2009-04-17
公開日2009-06-09
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structural Insights into the Regulatory Particle of the Proteasome from Methanocaldococcus jannaschii.
Mol.Cell, 34, 2009
3H4M
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AAA ATPASE DOMAIN OF THE PROTEASOME- ACTIVATING NUCLEOTIDASE
分子名称:Proteasome-activating nucleotidase, ADENOSINE-5'-DIPHOSPHATE
著者Jeffrey, P., Zhang, F., Hu, M., Tian, G., Zhang, P., Finley, D., Shi, Y.
登録日2009-04-20
公開日2009-06-09
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (3.106 Å)
主引用文献Structural Insights into the Regulatory Particle of the Proteasome from Methanocaldococcus jannaschii.
Mol.Cell, 34, 2009
3H4P
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PROTEASOME 20S CORE PARTICLE FROM METHANOCALDOCOCCUS JANNASCHII
分子名称:Proteasome subunit alpha, Proteasome subunit beta
著者Jeffrey, P.D., Zhang, F., Hu, M., Tian, G., Zhang, P., Finley, D., Shi, Y.
登録日2009-04-20
公開日2009-06-09
最終更新日2016-03-09
実験手法X-RAY DIFFRACTION (4.1 Å)
主引用文献Structural Insights into the Regulatory Particle of the Proteasome from Methanocaldococcus jannaschii.
Mol.Cell, 34, 2009
4AJD
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IDENTIFICATION AND STRUCTURAL CHARACTERIZATION OF PDE10 FRAGMENT INHIBITORS
分子名称:CAMP AND CAMP-INHIBITED CGMP 3', 5'-CYCLIC PHOSPHODIESTERASE 10A, PDE10, ...
著者Johansson, P., Albert, J.S., Spadola, L., Akerud, T., Back, E., Hillertz, P., Horsefeld, R., Scott, C., Spear, N., Tian, G., Tigerstrom, A., Aharony, D., Geschwindner, S.
登録日2012-02-16
公開日2013-03-06
最終更新日2018-04-04
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Identification and Structural Characterization of Pde10 Fragment Inhibitors
To be Published
4AJF
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IDENTIFICATION AND STRUCTURAL CHARACTERIZATION OF PDE10 FRAGMENT INHIBITORS
分子名称:CAMP AND CAMP-INHIBITED CGMP 3', 5'-CYCLIC PHOSPHODIESTERASE 10A, ZINC ION, ...
著者Johansson, P., Albert, J.S., Spadola, L., Akerud, T., Back, E., Hillertz, P., Horsefeld, R., Scott, C., Spear, N., Tian, G., Tigerstrom, A., Aharony, D., Geschwindner, S.
登録日2012-02-16
公開日2013-03-06
最終更新日2018-04-04
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Identification and Structural Characterization of Pde10 Fragment Inhibitors
To be Published
4AJG
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IDENTIFICATION AND STRUCTURAL CHARACTERIZATION OF PDE10 FRAGMENT INHIBITORS
分子名称:CAMP AND CAMP-INHIBITED CGMP 3', 5'-CYCLIC PHOSPHODIESTERASE 10A, ZINC ION, ...
著者Johansson, P., Albert, J.S., Spadola, L., Akerud, T., Back, E., Hillertz, P., Horsefeld, R., Scott, C., Spear, N., Tian, G., Tigerstrom, A., Aharony, D., Geschwindner, S.
登録日2012-02-16
公開日2013-03-06
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Identification and Structural Characterization of Pde10 Fragment Inhibitors
To be Published
4AJM
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DEVELOPMENT OF A PLATE-BASED OPTICAL BIOSENSOR METHODOLOGY TO IDENTIFY PDE10 FRAGMENT INHIBITORS
分子名称:CAMP AND CAMP-INHIBITED CGMP 3', 5'-CYCLIC PHOSPHODIESTERASE 10A, ZINC ION, ...
著者Geschwindner, S., Johansson, P., Spadola, L., Akerud, T., Back, E., Hillertz, P., Horsefeld, R., Scott, C., Spear, N., Tian, G., Tigerstrom, A., Aharony, D., Albert, J.S.
登録日2012-02-16
公開日2013-03-06
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Development of a Plate-Based Optical Biosensor Methodology to Identify Pde10 Fragment Inhibitors
To be Published
3SHY
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CRYSTAL STRUCTURE OF THE PDE5A1 CATALYTIC DOMAIN IN COMPLEX WITH NOVEL INHIBITORS
分子名称:cGMP-specific 3',5'-cyclic phosphodiesterase, 6-ethyl-5-fluoro-2-{5-[(4-methylpiperazin-1-yl)sulfonyl]-2-propoxyphenyl}pyrimidin-4(3H)-one, ZINC ION, ...
著者Chen, T.T., Chen, T., Xu, Y.C.
登録日2011-06-17
公開日2011-08-24
最終更新日2017-11-08
実験手法X-RAY DIFFRACTION (2.647 Å)
主引用文献Utilization of Halogen Bond in Lead Optimization: A Case Study of Rational Design of Potent Phosphodiesterase Type 5 (PDE5) Inhibitors.
J.Med.Chem., 54, 2011
3SHZ
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CRYSTAL STRUCTURE OF THE PDE5A1 CATALYTIC DOMAIN IN COMPLEX WITH NOVEL INHIBITORS
分子名称:cGMP-specific 3',5'-cyclic phosphodiesterase, 5-chloro-6-ethyl-2-{5-[(4-methylpiperazin-1-yl)sulfonyl]-2-propoxyphenyl}pyrimidin-4(3H)-one, ZINC ION, ...
著者Chen, T.T., Chen, T., Xu, Y.C.
登録日2011-06-17
公開日2011-08-24
最終更新日2017-11-08
実験手法X-RAY DIFFRACTION (2.449 Å)
主引用文献Utilization of Halogen Bond in Lead Optimization: A Case Study of Rational Design of Potent Phosphodiesterase Type 5 (PDE5) Inhibitors.
J.Med.Chem., 54, 2011
3SIE
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CRYSTAL STRUCTURE OF THE PDE5A1 CATALYTIC DOMAIN IN COMPLEX WITH NOVEL INHIBITORS
分子名称:cGMP-specific 3',5'-cyclic phosphodiesterase, 5-bromo-6-ethyl-2-{5-[(4-methylpiperazin-1-yl)sulfonyl]-2-propoxyphenyl}pyrimidin-4(3H)-one
著者Chen, T.T., Chen, T., Xu, Y.C.
登録日2011-06-17
公開日2011-08-24
最終更新日2012-06-27
実験手法X-RAY DIFFRACTION (1.93 Å)
主引用文献Utilization of Halogen Bond in Lead Optimization: A Case Study of Rational Design of Potent Phosphodiesterase Type 5 (PDE5) Inhibitors.
J.Med.Chem., 54, 2011
4G2W
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CRYSTAL STRUCTURE OF PDE5A IN COMPLEX WITH ITS INHIBITOR
分子名称:cGMP-specific 3',5'-cyclic phosphodiesterase, 5,6-diethyl-2-{5-[(4-methylpiperazin-1-yl)sulfonyl]-2-propoxyphenyl}pyrimidin-4(3H)-one, MAGNESIUM ION, ...
著者Ren, J., Chen, T.T., Xu, Y.C.
登録日2012-07-13
公開日2013-06-26
実験手法X-RAY DIFFRACTION (2.28 Å)
主引用文献Design, synthesis, and pharmacological evaluation of monocyclic pyrimidinones as novel inhibitors of PDE5.
J.Med.Chem., 55, 2012
4G2Y
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CRYSTAL STRUCTURE OF PDE5A COMPLEXED WITH ITS INHIBITOR
分子名称:cGMP-specific 3',5'-cyclic phosphodiesterase, DI(HYDROXYETHYL)ETHER, ZINC ION, ...
著者Ren, J., Chen, T.T., Xu, Y.C.
登録日2012-07-13
公開日2013-06-26
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Design, synthesis, and pharmacological evaluation of monocyclic pyrimidinones as novel inhibitors of PDE5.
J.Med.Chem., 55, 2012
2N3T
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SOLUTION STRUCTURE OF THE RPN1 SUBSTRATE RECEPTOR SITE TOROID 1 (T1)
分子名称:26S proteasome regulatory subunit RPN1
著者Chen, X., Walters, K.J.
登録日2015-06-10
公開日2016-02-24
最終更新日2016-03-23
実験手法SOLUTION NMR
主引用文献Rpn1 provides adjacent receptor sites for substrate binding and deubiquitination by the proteasome.
Science, 351, 2016
2N3U
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SOLUTION STRUCTURE OF THE RPN1 T1 SITE ENGAGING TWO MONOUBIQUITIN MOLECULES
分子名称:26S proteasome regulatory subunit RPN1, Ubiquitin-60S ribosomal protein L40
著者Chen, X., Walters, K.J.
登録日2015-06-10
公開日2016-02-24
最終更新日2016-03-23
実験手法SOLUTION NMR
主引用文献Rpn1 provides adjacent receptor sites for substrate binding and deubiquitination by the proteasome.
Science, 351, 2016
2N3V
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SOLUTION STRUCTURE OF THE RPN1 T1 SITE WITH K48-LINKED DIUBIQUITIN IN THE EXTENDED BINDING MODE
分子名称:26S proteasome regulatory subunit RPN1, Ubiquitin-60S ribosomal protein L40
著者Chen, X., Walters, K.J.
登録日2015-06-10
公開日2016-02-24
最終更新日2016-03-23
実験手法SOLUTION NMR
主引用文献Rpn1 provides adjacent receptor sites for substrate binding and deubiquitination by the proteasome.
Science, 351, 2016
2N3W
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SOLUTION STRUCTURE OF THE RPN1 T1 SITE WITH K48-LINKED DIUBIQUITIN IN THE CONTRACTED BINDING MODE
分子名称:26S proteasome regulatory subunit RPN1, Ubiquitin-60S ribosomal protein L40
著者Chen, X., Walters, K.J.
登録日2015-06-10
公開日2016-02-24
最終更新日2016-03-23
実験手法SOLUTION NMR
主引用文献Rpn1 provides adjacent receptor sites for substrate binding and deubiquitination by the proteasome.
Science, 351, 2016
4JPO
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5A RESOLUTION STRUCTURE OF PROTEASOME ASSEMBLY CHAPERONE HSM3 IN COMPLEX WITH A C-TERMINAL FRAGMENT OF RPT1
分子名称:DNA mismatch repair protein HSM3, 26S protease regulatory subunit 7 homolog
著者Lovell, S., Battaile, K.P., Singh, R., Roelofs, J.
登録日2013-03-19
公開日2013-04-10
最終更新日2017-11-15
実験手法X-RAY DIFFRACTION (5 Å)
主引用文献Reconfiguration of the proteasome during chaperone-mediated assembly.
Nature, 497, 2013
5YYF
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CRYSTAL STRUCUTRE OF AF9 YEATS DOMAIN IN COMPLEX WITH A PEPTIDE INHIBITOR "PHQ-H3(Q5-K9)" MODIFIED AT K9 WITH 2-FURANCARBOYL GROUP
分子名称:Protein AF-9, Peptide inhibitor PHQ-H3(Q5-K9), SULFATE ION, ...
著者Li, Y., Li, H.
登録日2017-12-09
公開日2018-11-07
最終更新日2018-11-28
実験手法X-RAY DIFFRACTION (1.903 Å)
主引用文献Structure-guided development of YEATS domain inhibitors by targeting pi-pi-pi stacking.
Nat. Chem. Biol., 14, 2018