Author results

1ELS
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CATALYTIC METAL ION BINDING IN ENOLASE: THE CRYSTAL STRUCTURE OF ENOLASE-MN2+-PHOSPHONOACETOHYDROXAMATE COMPLEX AT 2.4 ANGSTROMS RESOLUTION
Descriptor:ENOLASE, MANGANESE (II) ION, PHOSPHONOACETOHYDROXAMIC ACID
Authors:Zhang, E., Hatada, M., Brewer, J.M., Lebioda, L.
Deposit date:1994-04-05
Release date:1994-07-31
Last modified:2017-11-29
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Catalytic metal ion binding in enolase: the crystal structure of an enolase-Mn2+-phosphonoacetohydroxamate complex at 2.4-A resolution.
Biochemistry, 33, 1994
1FAK
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HUMAN TISSUE FACTOR COMPLEXED WITH COAGULATION FACTOR VIIA INHIBITED WITH A BPTI-MUTANT
Descriptor:PROTEIN (BLOOD COAGULATION FACTOR VIIA), PROTEIN (SOLUBLE TISSUE FACTOR), PROTEIN (5L15), ...
Authors:Zhang, E., St Charles, R., Tulinsky, A.
Deposit date:1998-12-28
Release date:1999-12-03
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structure of extracellular tissue factor complexed with factor VIIa inhibited with a BPTI mutant.
J.Mol.Biol., 285, 1999
1HXE
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SERINE PROTEASE
Descriptor:THROMBIN, HIRUDIN VARIANT-1, RUBIDIUM ION
Authors:Tulinsky, A., Zhang, E.
Deposit date:1995-12-07
Release date:1996-11-08
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:The molecular environment of the Na+ binding site of thrombin.
Biophys.Chem., 63, 1997
1HXF
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HUMAN THROMBIN COMPLEX WITH HIRUDIN VARIANT
Descriptor:THROMBIN, HIRUDIN VARIANT
Authors:Tulinsky, A., Zhang, E.
Deposit date:1996-09-09
Release date:1997-01-27
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:The molecular environment of the Na+ binding site of thrombin.
Biophys.Chem., 63, 1997
2PHB
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AN ORALLY EFFICACIOUS FACTOR XA INHIBITOR
Descriptor:Coagulation factor X, heavy chain, light chain, ...
Authors:Zhang, E., Kohrt, J.T., Bigge, C.F., Finzel, B.C.
Deposit date:2007-04-10
Release date:2008-03-25
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:The discovery of (2R,4R)-N-(4-chlorophenyl)-N- (2-fluoro-4-(2-oxopyridin-1(2H)-yl)phenyl)-4-methoxypyrrolidine-1,2-dicarboxamide (PD 0348292), an orally efficacious factor Xa inhibitor
Chem.Biol.Drug Des., 70, 2007
2PR3
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FACTOR XA INHIBITOR
Descriptor:COAGULATION FACTOR X, HEAVY CHAIN, LIGHT CHAIN, ...
Authors:Zhang, E., Kohrt, J.T., Bigge, C.F., Finzel, B.C.
Deposit date:2007-05-03
Release date:2007-08-14
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Structure-based drug design of pyrrolidine-1, 2-dicarboxamides as a novel series of orally bioavailable factor Xa inhibitors
Chem.Biol.Drug Des., 69, 2007
3EQB
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X-RAY STRUCTURE OF THE HUMAN MITOGEN-ACTIVATED PROTEIN KINASE KINASE 1 (MEK1) IN A COMPLEX WITH LIGAND AND MGATP
Descriptor:Dual specificity mitogen-activated protein kinase kinase 1, ADENOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, ...
Authors:Ohren, J.F., Pavlovsky, A., Zhang, E.
Deposit date:2008-09-30
Release date:2008-11-11
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.62 Å)
Cite:2-Alkylamino- and alkoxy-substituted 2-amino-1,3,4-oxadiazoles-O-Alkyl benzohydroxamate esters replacements retain the desired inhibition and selectivity against MEK (MAP ERK kinase).
Bioorg.Med.Chem.Lett., 18, 2008
1TWX
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CRYSTAL STRUCTURE OF THE THROMBIN MUTANT D221A/D222K
Descriptor:Prothrombin, Hirudin, N-ACETYL-D-GLUCOSAMINE
Authors:Pineda, A.O., Zhang, E., Guinto, E.R., Savvides, S.N., Tulinsky, A., Di Cera, E.
Deposit date:2004-07-01
Release date:2005-04-19
Last modified:2013-10-09
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Crystal structure of the thrombin mutant D221A/D222K: the Asp222:Arg187 ion-pair stabilizes the fast form
Biophys.Chem., 112, 2004
2FS4
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KETOPIPERAZINE-BASED RENIN INHIBITORS: OPTIMIZATION OF THE C RING
Descriptor:Renin, (6R)-6-({[1-(3-HYDROXYPROPYL)-1,7-DIHYDROQUINOLIN-7-YL]OXY}METHYL)-1-(4-{3-[(2-METHOXYBENZYL)OXY]PROPOXY}PHENYL)PIPERAZIN-2-ONE
Authors:Holsworth, D.D., Cai, C., Cheng, X.-M., Cody, W.L., Downing, D.M., Erasga, N., Lee, C., Powell, N.A., Edmunds, J.J., Stier, M., Jalaie, M., Zhang, E., McConnell, P., Ryan, M.J., Bryant, J., Li, T., Kasani, A., Hall, E., Subedi, R., Rahim, M., Maiti, S.
Deposit date:2006-01-20
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Ketopiperazine-Based Renin Inhibitors: Optimization of the "C" Ring
BIOORG.MED.CHEM.LETT., 16, 2006
4WKR
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LARP7 WRAPPING UP THE 3' HAIRPIN OF 7SK NON-CODING RNA (302-332)
Descriptor:La-related protein 7, 7SK GGHP4 (300-332)
Authors:Uchikawa, E., Natchiar, K.S., Han, X., Proux, F., Roblin, P., Zhang, E., Durand, A., Klaholz, B.P., Dock-Bregeon, A.-C.
Deposit date:2014-10-03
Release date:2015-03-18
Last modified:2015-04-15
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:Structural insight into the mechanism of stabilization of the 7SK small nuclear RNA by LARP7.
Nucleic Acids Res., 43, 2015
1NEL
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FLUORIDE INHIBITION OF YEAST ENOLASE: CRYSTAL STRUCTURE OF THE ENOLASE-MG2+-F--PI COMPLEX AT 2.6-ANGSTROMS RESOLUTION
Descriptor:ENOLASE, MAGNESIUM ION, PHOSPHATE ION, ...
Authors:Lebioda, L., Zhang, E., Lewinski, K., Brewer, M.J.
Deposit date:1993-08-20
Release date:1994-01-31
Last modified:2017-11-29
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Fluoride inhibition of yeast enolase: crystal structure of the enolase-Mg(2+)-F(-)-Pi complex at 2.6 A resolution.
Proteins, 16, 1993
1A46
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THROMBIN COMPLEXED WITH HIRUGEN AND A BETA-STRAND MIMETIC INHIBITOR
Descriptor:ALPHA-THROMBIN (SMALL SUBUNIT), ALPHA-THROMBIN (LARGE SUBUNIT), HIRUGEN, ...
Authors:St Charles, R., Matthews, J.H., Zhang, E., Tulinsky, A., Kahn, M.
Deposit date:1998-02-11
Release date:1998-05-27
Last modified:2012-12-12
Method:X-RAY DIFFRACTION (2.12 Å)
Cite:Bound structures of novel P3-P1' beta-strand mimetic inhibitors of thrombin.
J.Med.Chem., 42, 1999
1A61
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THROMBIN COMPLEXED WITH A BETA-MIMETIC THIAZOLE-CONTAINING INHIBITOR
Descriptor:ALPHA-THROMBIN (SMALL SUBUNIT), ALPHA-THROMBIN (LARGE SUBUNIT), HIRUGEN, ...
Authors:St Charles, R., Matthews, J.H., Zhang, E., Tulinsky, A., Kahn, M.
Deposit date:1998-03-05
Release date:1998-06-17
Last modified:2012-12-12
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Bound structures of novel P3-P1' beta-strand mimetic inhibitors of thrombin.
J.Med.Chem., 42, 1999
1BA8
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THROMBIN INHIBITOR WITH A RIGID TRIPEPTIDYL ALDEHYDES
Descriptor:THROMBIN, HIRUGEN, amino({(4S)-4-[({(3S)-3-[(benzylsulfonyl)amino]-2-oxopiperidin-1-yl}acetyl)amino]-5-oxopentyl}amino)methaniminium, ...
Authors:Krishnan, R., Zhang, E., Hakansson, K., Arni, R.K., Tulinsky, A., Lim-Wilby, M.S.L., Levy, O.E., Semple, J.E., Brunck, T.K.
Deposit date:1998-04-23
Release date:1999-04-27
Last modified:2012-12-12
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Highly selective mechanism-based thrombin inhibitors: structures of thrombin and trypsin inhibited with rigid peptidyl aldehydes.
Biochemistry, 37, 1998
1BB0
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THROMBIN INHIBITORS WITH RIGID TRIPEPTIDYL ALDEHYDES
Descriptor:THROMBIN, HIRUGEN, SODIUM ION, ...
Authors:Krishnan, R., Zhang, E., Hakansson, K., Arni, R.K., Tulinsky, A., Lim-Wilby, M.S.L., Levy, O.E., Semple, J.E., Brunck, T.K.
Deposit date:1998-04-28
Release date:1999-04-27
Last modified:2012-12-12
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Highly selective mechanism-based thrombin inhibitors: structures of thrombin and trypsin inhibited with rigid peptidyl aldehydes.
Biochemistry, 37, 1998
1CA8
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THROMBIN INHIBITORS WITH RIGID TRIPEPTIDYL ALDEHYDES
Descriptor:Thrombin light chain, Thrombin heavy chain, HIRUGEN, ...
Authors:Krishnan, R., Zhang, E., Hakansson, K., Arni, R.K., Tulinsky, A., Lim-Wilby, M.S.L., Levy, O.E., Semple, J.E., Brunck, T.K.
Deposit date:1998-04-27
Release date:1999-04-27
Last modified:2012-12-12
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Highly selective mechanism-based thrombin inhibitors: structures of thrombin and trypsin inhibited with rigid peptidyl aldehydes
Biochemistry, 37, 1998
1EWA
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DEHALOPEROXIDASE AND 4-IODOPHENOL
Descriptor:DEHALOPEROXIDASE, SULFATE ION, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:LaCount, M.W., Zhang, E., Chen, Y.P., Han, K., Whitton, M.M., Lincoln, D.E., Woodin, S.A., Lebioda, L.
Deposit date:2000-04-24
Release date:2000-05-10
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:The crystal structure and amino acid sequence of dehaloperoxidase from Amphitrite ornata indicate common ancestry with globins
J.Biol.Chem., 275, 2000
1YYY
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TRYPSIN INHIBITORS WITH RIGID TRIPEPTIDYL ALDEHYDES
Descriptor:TRYPSIN, CALCIUM ION, 2-{(3S)-3-[(benzylsulfonyl)amino]-2-oxopiperidin-1-yl}-N-{(2S)-1-[(3S)-1-carbamimidoylpiperidin-3-yl]-3-oxopropan-2-yl}acetamide
Authors:Krishnan, R., Zhang, E., Hakansson, K., Arni, R.K., Tulinsky, A., Lim-Wilby, M.S.L., Levy, O.E., Semple, J.E., Brunck, T.K.
Deposit date:1998-06-03
Release date:1999-06-08
Last modified:2012-12-12
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Highly selective mechanism-based thrombin inhibitors: structures of thrombin and trypsin inhibited with rigid peptidyl aldehydes.
Biochemistry, 37, 1998
1ZZZ
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TRYPSIN INHIBITORS WITH RIGID TRIPEPTIDYL ALDEHYDES
Descriptor:TRYPSIN, 2-{(3S)-3-[(benzylsulfonyl)amino]-2-oxopiperidin-1-yl}-N-{(2S)-1-[(3R)-1-carbamimidoylpiperidin-3-yl]-3-oxopropan-2-yl}acetamide, CALCIUM ION
Authors:Krishnan, R., Zhang, E., Hakansson, K., Arni, R.K., Tulinsky, A., Lim-Wilby, M.S.L., Levy, O.E., Semple, J.E., Brunck, T.K.
Deposit date:1998-06-02
Release date:1999-06-15
Last modified:2012-12-12
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Highly selective mechanism-based thrombin inhibitors: structures of thrombin and trypsin inhibited with rigid peptidyl aldehydes.
Biochemistry, 37, 1998
2BKS
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CRYSTAL STRUCTURE OF RENIN-PF00074777 COMPLEX
Descriptor:RENIN, (6R)-6-({[1-(3-HYDROXYPROPYL)-1,7-DIHYDROQUINOLIN-7-YL]OXY}METHYL)-1-(4-{3-[(2-METHOXYBENZYL)OXY]PROPOXY}PHENYL)PIPERAZIN-2-ONE
Authors:Powell, N.A., Clay, E.H., Holsworth, D.D., Edmunds, J.J., Bryant, J.W., Ryan, J.M., Jalaie, M., Zhang, E.
Deposit date:2005-02-18
Release date:2006-04-05
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Equipotent Activity in Both Enantiomers of a Series of Ketopiperazine-Based Renin Inhibitors
Bioorg.Med.Chem.Lett., 15, 2005
2BKT
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CRYSTAL STRUCTURE OF RENIN-PF00257567 COMPLEX
Descriptor:RENIN, 1-{4-[3-(2-METHOXY-BENZYLOXY)-PROPOXY]-PHENYL}-6-(1,2,,3,4-TETRAHYDRO-QUINOLIN-7-YLOXYMETHYL)-PIPERAZIN-2-ONE
Authors:Powell, N.A., Clay, E.H., Holsworth, D.D., Edmunds, J.J., Bryant, J.W., Ryan, J.M., Jalaie, M., Zhang, E.
Deposit date:2005-02-18
Release date:2006-04-05
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Equipotent Activity in Both Enantiomers of a Series of Ketopiperazine-Based Renin Inhibitors
Bioorg.Med.Chem.Lett., 15, 2005
2C4F
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CRYSTAL STRUCTURE OF FACTOR VII.STF COMPLEXED WITH PD0297121
Descriptor:COAGULATION FACTOR VII PRECURSOR, TISSUE FACTOR PRECURSOR, CALCIUM ION, ...
Authors:Kohrt, J.T., Zhang, E.
Deposit date:2005-10-18
Release date:2006-10-18
Last modified:2017-07-12
Method:X-RAY DIFFRACTION (1.72 Å)
Cite:The Discovery of Fluoropyridine-Based Inhibitors of the Factor Viia/Tf Complex--Part 2
Bioorg.Med.Chem.Lett., 16, 2006
2I4Q
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HUMAN RENIN/PF02342674 COMPLEX
Descriptor:Renin, (2S)-6-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-2-(3,5-DIFLUOROPHENYL)-4-(3-METHOXYPROPYL)-2-METHYL-2H-1,4-BENZOXAZIN-3(4H)-ONE
Authors:Holsworth, D.D., Jalaie, M., Zhang, E., Mcconnell, P., Mochalkin, I., Finzel, B.C.
Deposit date:2006-08-22
Release date:2006-10-24
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Rational design of 6-(2,4-diaminopyrimidinyl)-1,4-benzoxazin-3-ones as small molecule renin inhibitors.
Bioorg.Med.Chem., 15, 2007
2Q1J
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THE DISCOVERY OF GLYCINE AND RELATED AMINO ACID-BASED FACTOR XA INHIBITORS
Descriptor:Activated factor Xa heavy chain (EC 3.4.21.6), Factor X light chain (EC 3.4.21.6), CALCIUM ION, ...
Authors:Kohrt, J.T., Filipski, K.J., Cody, W.L., Bigge, C.F., Zhang, E., Finzel, B.C.
Deposit date:2007-05-24
Release date:2007-08-14
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:The Discovery of Glycine and Related Amino Acid-Based Factor Xa Inhibitors
BIOORG.MED.CHEM., 14, 2006
4CVN
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STRUCTURE OF THE FAP7-RPS14 COMPLEX
Descriptor:PUTATIVE ADENYLATE KINASE, 30S RIBOSOMAL PROTEIN S11, ADENOSINE-5'-DIPHOSPHATE, ...
Authors:Loch, J., Blaud, M., Rety, S., Lebaron, S., Deschamps, P., Bareille, J., Jombart, J., Robert-Paganin, J., Delbos, L., Chardon, F., Zhang, E., Charenton, C., Tollervey, D., Leulliot, N.
Deposit date:2014-03-28
Release date:2014-05-28
Method:X-RAY DIFFRACTION (2.121 Å)
Cite:RNA Mimicry by the Fap7 Adenylate Kinase in Ribosome Biogenesis
Plos Biol., 12, 2014
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