Author results

1MG2
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MUTATION OF ALPHA PHE55 OF METHYLAMINE DEHYDROGENASE ALTERS THE REORGANIZATION ENERGY AND ELECTRONIC COUPLING FOR ITS ELECTRON TRANSFER REACTION WITH AMICYANIN
Descriptor:Methylamine dehydrogenase, heavy chain, light chain, ...
Authors:Sun, D., Chen, Z.W., Mathews, F.S., Davidson, V.L.
Deposit date:2002-08-14
Release date:2002-12-11
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:MUTATION OF AlPHA PHE55 OF METHYLAMINE DEHYDROGENASE ALTERS THE REORGANIZATION ENERGY AND ELECTRONIC COUPLING FOR ITS ELECTRON TRANSFER REACTION WITH AMICYANIN
Biochemistry, 41, 2002
1MG3
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MUTATION OF ALPHA PHE55 OF METHYLAMINE DEHYDROGENASE ALTERS THE REORGANIZATION ENERGY AND ELECTRONIC COUPLING FOR ITS ELECTRON TRANSFER REACTION WITH AMICYANIN
Descriptor:Methylamine dehydrogenase, heavy chain, light chain, ...
Authors:Sun, D., Chen, Z.W., Mathews, F.S., Davidson, V.L.
Deposit date:2002-08-14
Release date:2002-12-11
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:MUTATION OF ALPHA PHE55 OF METHYLAMINE DEHYDROGENASE ALTERS THE REORGANIZATION ENERGY AND ELECTRONIC COUPLING FOR ITS ELECTRON TRANSFER REACTION WITH AMICYANIN
Biochemistry, 41, 2002
3K8T
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STRUCTURE OF EUKARYOTIC RNR LARGE SUBUNIT R1 COMPLEXED WITH DESIGNED ADP ANALOG COMPOUND
Descriptor:Ribonucleoside-diphosphate reductase large chain 1, MAGNESIUM ION, 2'-DEOXYGUANOSINE-5'-TRIPHOSPHATE, ...
Authors:Sun, D., Xu, H., Dealwis, C., Lee, R.E.
Deposit date:2009-10-14
Release date:2010-03-02
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structure-Based Design, Synthesis, and Evaluation of 2'-(2-Hydroxyethyl)-2'-deoxyadenosine and the 5'-Diphosphate Derivative as Ribonucleotide Reductase Inhibitors
Chemmedchem, 4, 2009
3QWY
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CED-2
Descriptor:Cell death abnormality protein 2, SULFATE ION, GLYCEROL
Authors:Kang, Y., Sun, J., Liu, Y., Sun, D., Hu, Y., Liu, Y.F.
Deposit date:2011-02-28
Release date:2011-06-08
Last modified:2011-07-20
Method:X-RAY DIFFRACTION (2.52 Å)
Cite:Crystal structure of the cell corpse engulfment protein CED-2 in Caenorhabditis elegans.
Biochem.Biophys.Res.Commun., 410, 2011
1D0E
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CRYSTAL STRUCTURES OF THE N-TERMINAL FRAGMENT FROM MOLONEY MURINE LEUKEMIA VIRUS REVERSE TRANSCRIPTASE COMPLEXED WITH NUCLEIC ACID: FUNCTIONAL IMPLICATIONS FOR TEMPLATE-PRIMER BINDING TO THE FINGERS DOMAIN
Descriptor:5'-D(*TP*TP*TP*CP*AP*TP*GP*CP*AP*TP*G)-3', REVERSE TRANSCRIPTASE
Authors:Najmudin, S., Cote, M.L., Sun, D., Yohannan, S., Montano, S.P., Gu, J., Georgiadis, M.M.
Deposit date:1999-09-09
Release date:2000-04-04
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (3 Å)
Cite:Crystal structures of an N-terminal fragment from Moloney murine leukemia virus reverse transcriptase complexed with nucleic acid: functional implications for template-primer binding to the fingers domain
J.Mol.Biol., 296, 2000
1QAI
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CRYSTAL STRUCTURES OF THE N-TERMINAL FRAGMENT FROM MOLONEY MURINE LEUKEMIA VIRUS REVERSE TRANSCRIPTASE COMPLEXED WITH NUCLEIC ACID: FUNCTIONAL IMPLICATIONS FOR TEMPLATE-PRIMER BINDING TO THE FINGERS DOMAIN
Descriptor:DNA (5'-D(*CP*AP*TP*GP*CP*AP*TP*G)-3'), REVERSE TRANSCRIPTASE, MERCURY (II) ION
Authors:Najmudin, S., Cote, M., Sun, D., Yohannan, S., Montano, S.P., Gu, J., Georgiadis, M.M.
Deposit date:1999-03-12
Release date:2000-03-20
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structures of an N-terminal fragment from Moloney murine leukemia virus reverse transcriptase complexed with nucleic acid: functional implications for template-primer binding to the fingers domain.
J.Mol.Biol., 296, 2000
1QAJ
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CRYSTAL STRUCTURES OF THE N-TERMINAL FRAGMENT FROM MOLONEY MURINE LEUKEMIA VIRUS REVERSE TRANSCRIPTASE COMPLEXED WITH NUCLEIC ACID: FUNCTIONAL IMPLICATIONS FOR TEMPLATE-PRIMER BINDING TO THE FINGERS DOMAIN
Descriptor:DNA (5'-D(*CP*AP*TP*GP*CP*AP*TP*G)-3'), REVERSE TRANSCRIPTASE
Authors:Najmudin, S., Cote, M., Sun, D., Yohannan, S., Montano, S.P., Gu, J., Georgiadis, M.M.
Deposit date:1999-03-18
Release date:2000-04-02
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structures of an N-terminal fragment from Moloney murine leukemia virus reverse transcriptase complexed with nucleic acid: functional implications for template-primer binding to the fingers domain.
J.Mol.Biol., 296, 2000
4JV7
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CO-CRYSTAL STRUCTURE OF MDM2 WITH INHIBITOR (2S,5R,6S)-2-BENZYL-5,6-BIS(4-BROMOPHENYL)-4-METHYLMORPHOLIN-3-ONE
Descriptor:E3 ubiquitin-protein ligase Mdm2, (2S,5R,6S)-2-benzyl-5,6-bis(4-bromophenyl)-4-methylmorpholin-3-one, SULFATE ION
Authors:Huang, X., Gonzalez-Lopez de Turiso, F., Sun, D., Yosup, R., Bartberger, M.D., Beck, H.P., Cannon, J., Shaffer, P., Oliner, J.D., Olson, S.H., Medina, J.C.
Deposit date:2013-03-25
Release date:2013-05-01
Last modified:2013-06-05
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Rational Design and Binding Mode Duality of MDM2-p53 Inhibitors.
J.Med.Chem., 56, 2013
4JV9
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CO-CRYSTAL STRUCTURE OF MDM2 WITH INHIBITOR (2S,5R,6S)-2-BENZYL-5,6-BIS(4-CHLOROPHENYL)-4-METHYLMORPHOLIN-3-ONE
Descriptor:E3 ubiquitin-protein ligase Mdm2, (2S,5R,6S)-2-benzyl-5,6-bis(4-chlorophenyl)-4-methylmorpholin-3-one, SULFATE ION
Authors:Huang, X., Gonzalez-Lopez de Turiso, F., Sun, D., Yosup, R., Bartberger, M.D., Beck, H.P., Cannon, J., Shaffer, P., Oliner, J.D., Olson, S.H., Medina, J.C.
Deposit date:2013-03-25
Release date:2013-05-01
Last modified:2013-06-05
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Rational Design and Binding Mode Duality of MDM2-p53 Inhibitors.
J.Med.Chem., 56, 2013
4JVE
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CO-CRYSTAL STRUCTURE OF MDM2 WITH INHIBITOR (2R,3E)-2-[(2S,3R,6S)-2,3-BIS(4-CHLOROPHENYL)-6-(4-FLUOROBENZYL)-5-OXOMORPHOLIN-4-YL]PENT-3-ENOIC ACID
Descriptor:E3 ubiquitin-protein ligase Mdm2, (2R,3E)-2-[(2S,3R,6S)-2,3-bis(4-chlorophenyl)-6-(4-fluorobenzyl)-5-oxomorpholin-4-yl]pent-3-enoic acid
Authors:Huang, X., Gonzalez-Lopez de Turiso, F., Sun, D., Yosup, R., Bartberger, M.D., Beck, H.P., Cannon, J., Shaffer, P., Oliner, J.D., Olson, S.H., Medina, J.C.
Deposit date:2013-03-25
Release date:2013-05-01
Last modified:2013-06-05
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Rational Design and Binding Mode Duality of MDM2-p53 Inhibitors.
J.Med.Chem., 56, 2013
4JVR
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CO-CRYSTAL STRUCTURE OF MDM2 WITH INHIBITOR (2'S,3R,4'S,5'R)-N-(2-AMINOETHYL)-6-CHLORO-4'-(3-CHLORO-2-FLUOROPHENYL)-2'-(2,2-DIMETHYLPROPYL)-2-OXO-1,2-DIHYDROSPIRO[INDOLE-3,3'-PYRROLIDINE]-5'-CARBOXAMIDE
Descriptor:E3 ubiquitin-protein ligase Mdm2, (2'S,3R,4'S,5'R)-N-(2-aminoethyl)-6-chloro-4'-(3-chloro-2-fluorophenyl)-2'-(2,2-dimethylpropyl)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-5'-carboxamide
Authors:Huang, X., Gonzalez-Lopez de Turiso, F., Sun, D., Yosup, R., Bartberger, M.D., Beck, H.P., Cannon, J., Shaffer, P., Oliner, J.D., Olson, S.H., Medina, J.C.
Deposit date:2013-03-26
Release date:2013-05-01
Last modified:2013-06-05
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Rational Design and Binding Mode Duality of MDM2-p53 Inhibitors.
J.Med.Chem., 56, 2013
1SF3
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STRUCTURE OF THE REDUCED FORM OF THE P94A MUTANT OF AMICYANIN
Descriptor:Amicyanin, COPPER (I) ION, PHOSPHATE ION
Authors:Carrell, C.J., Sun, D., Jiang, S., Davidson, V.L., Mathews, F.S.
Deposit date:2004-02-19
Release date:2004-07-27
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:Structural Studies of Two Mutants of Amicyanin from Paracoccus denitrificans That Stabilize the Reduced State of the Copper.
Biochemistry, 43, 2004
1SF5
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STRUCTURE OF OXIDIZED STATE OF THE P94A MUTANT OF AMICYANIN
Descriptor:Amicyanin, COPPER (II) ION
Authors:Carrell, C.J., Sun, D., Jiang, S., Davidson, V.L., Mathews, F.S.
Deposit date:2004-02-19
Release date:2004-07-27
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Structural Studies of Two Mutants of Amicyanin from Paracoccus denitrificans That Stabilize the Reduced State of the Copper.
Biochemistry, 43, 2004
1SFD
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OXIDIZED FORM OF AMICYANIN MUTANT P94F
Descriptor:Amicyanin, COPPER (II) ION, SULFATE ION
Authors:Carrell, C.J., Sun, D., Jiang, S., Davidson, V.L., Mathews, F.S.
Deposit date:2004-02-19
Release date:2004-07-27
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (0.99 Å)
Cite:Structural Studies of Two Mutants of Amicyanin from Paracoccus denitrificans That Stabilize the Reduced State of the Copper.
Biochemistry, 43, 2004
1SFH
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REDUCED STATE OF AMICYANIN MUTANT P94F
Descriptor:Amicyanin, COPPER (I) ION, SODIUM ION
Authors:Carrell, C.J., Sun, D., Jiang, S., Davidson, V.L., Mathews, F.S.
Deposit date:2004-02-19
Release date:2004-07-27
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:Structural Studies of Two Mutants of Amicyanin from Paracoccus denitrificans That Stabilize the Reduced State of the Copper.
Biochemistry, 43, 2004
1ZYF
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STRUCTURE OF A SUPERCOILING RESPONSIVE DNA SITE
Descriptor:5'-D(*CP*AP*AP*CP*CP*AP*TP*GP*GP*TP*TP*G)-3'
Authors:Bae, S.H., Yun, S.H., Sun, D., Lim, H.M., Choi, B.S.
Deposit date:2005-06-10
Release date:2006-05-23
Last modified:2011-07-13
Method:SOLUTION NMR
Cite:Structural and dynamic basis of a supercoiling-responsive DNA element
Nucleic Acids Res., 34, 2006
1ZYG
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STRUCTURE OF A SUPERCOILING RESPONSIVE DNA SITE
Descriptor:5'-D(*CP*AP*AP*CP*CP*CP*GP*GP*GP*TP*TP*G)-3'
Authors:Bae, S.H., Yun, S.H., Sun, D., Lim, H.M., Choi, B.S.
Deposit date:2005-06-10
Release date:2006-05-23
Last modified:2011-07-13
Method:SOLUTION NMR
Cite:Structural and dynamic basis of a supercoiling-responsive DNA element
Nucleic Acids Res., 34, 2006
1ZYH
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STRUCTURE OF A SUPERCOILING RESPONSIVE DNA SITE
Descriptor:5'-D(*CP*AP*AP*CP*CP*AP*GP*GP*GP*TP*TP*G)-3', 5'-D(*CP*AP*AP*CP*CP*CP*TP*GP*GP*TP*TP*G)-3'
Authors:Bae, S.H., Yun, S.H., Sun, D., Lim, H.M., Choi, B.S.
Deposit date:2005-06-10
Release date:2006-05-23
Last modified:2011-07-13
Method:SOLUTION NMR
Cite:Structural and dynamic basis of a supercoiling-responsive DNA element
Nucleic Acids Res., 34, 2006
4RG8
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STRUCTURAL AND BIOCHEMICAL STUDIES OF A MODERATELY THERMOPHILIC EXONUCLEASE I FROM METHYLOCALDUM SZEGEDIENSE
Descriptor:Exonuclease I, MAGNESIUM ION
Authors:Fei, L., Tian, S., Moysey, R., Misca, M., Barker, J.J., Smith, M.A., McEwan, P.A., Pilka, E.S., Crawley, L., Evans, T., Sun, D.
Deposit date:2014-09-29
Release date:2015-02-25
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (2.12 Å)
Cite:Structural and Biochemical Studies of a Moderately Thermophilic Exonuclease I from Methylocaldum szegediense.
Plos One, 10, 2015
4KB5
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CRYSTAL STRUCTURE OF MYCP1 FROM MYCOBACTERIUM SMEGMATIS
Descriptor:Membrane-anchored mycosin mycp1, GLYCEROL
Authors:Sun, D.M., He, Y., Tian, C.L.
Deposit date:2013-04-23
Release date:2014-02-05
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:The putative propeptide of MycP1 in mycobacterial type VII secretion system does not inhibit protease activity but improves protein stability.
Protein Cell, 4, 2013
4OAS
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CO-CRYSTAL STRUCTURE OF MDM2 (17-111) IN COMPLEX WITH COMPOUND 25
Descriptor:E3 ubiquitin-protein ligase Mdm2, [(3R,5R,6S)-1-[(2S)-1-(tert-butylsulfonyl)butan-2-yl]-5-(3-chlorophenyl)-6-(4-chlorophenyl)-3-methyl-2-oxopiperidin-3-yl]acetic acid, SULFATE ION
Authors:Huang, X.
Deposit date:2014-01-06
Release date:2014-02-19
Last modified:2014-03-12
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Discovery of AMG 232, a Potent, Selective, and Orally Bioavailable MDM2-p53 Inhibitor in Clinical Development.
J.Med.Chem., 57, 2014
3CZR
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CRYSTAL STRUCTURE OF HUMAN 11-BETA-HYDROXYSTEROID DEHYDROGENASE (HSD1) IN COMPLEX WITH ARYLSULFONYLPIPERAZINE INHIBITOR
Descriptor:Corticosteroid 11-beta-dehydrogenase isozyme 1, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, (2R)-1-[(4-tert-butylphenyl)sulfonyl]-2-methyl-4-(4-nitrophenyl)piperazine, ...
Authors:Wang, Z., Sudom, A., Walker, N.P.
Deposit date:2008-04-29
Release date:2008-06-17
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Discovery and Initial SAR of Arylsulfonylpiperazine Inhibitors of 11beta-Hydroxysteroid Dehydrogenase Type 1 (11beta-HSD1)
Bioorg.Med.Chem.Lett., 18, 2008
3PDJ
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CRYSTAL STRUCTURE OF HUMAN 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 (11B-HSD1) IN COMPLEX WITH 4,4-DISUBSTITUTED CYCLOHEXYLBENZAMIDE INHIBITOR
Descriptor:Corticosteroid 11-beta-dehydrogenase isozyme 1, N-[trans-4-(3-amino-3-oxopropyl)-4-phenylcyclohexyl]-N-cyclopropyl-4-[(1S)-2,2,2-trifluoro-1-hydroxy-1-methylethyl]benzamide, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Wang, Z., Sudom, A., Walker, N.P.
Deposit date:2010-10-22
Release date:2011-10-05
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Synthesis and Optimization of Novel 4,4-Disubstituted Cyclohexylbenzamide Derivatives as Potent 11beta-HSD1 Inhibitors
Bioorg.Med.Chem.Lett., 21, 2011
3QWX
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CED-2 1-174
Descriptor:Cell death abnormality protein 2, SULFATE ION
Authors:Kang, Y., Sun, J., Liu, Y.
Deposit date:2011-02-28
Release date:2011-06-08
Last modified:2011-07-20
Method:X-RAY DIFFRACTION (2.01 Å)
Cite:Crystal structure of the cell corpse engulfment protein CED-2 in Caenorhabditis elegans.
Biochem.Biophys.Res.Commun., 410, 2011
5TD9
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STRUCTURE OF HUMAN ENOLASE 2
Descriptor:Gamma-enolase, MAGNESIUM ION, CHLORIDE ION
Authors:Leonard, P.G., Muller, F.L.
Deposit date:2016-09-19
Release date:2017-09-27
Method:X-RAY DIFFRACTION (2.318 Å)
Cite:Pomhex, a cell-permeable Enolase inhibitor for Collateral Lethality targeting of ENO1-deleted Glioblastoma
To Be Published