Author results

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
2AWU
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SYNAPSE ASSOCIATED PROTEIN 97 PDZ2 DOMAIN VARIANT C378G
Descriptor:Synapse-associated protein 97, AHH
Authors:Von Ossowski, I., Oksanen, E., Von Ossowski, L., Cai, C., Sundberg, M., Goldman, A., Keinanen, K.
Deposit date:2005-09-02
Release date:2006-08-29
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (2.44 Å)
Cite:Crystal structure of the second PDZ domain of SAP97 in complex with a GluR-A C-terminal peptide
Febs J., 273, 2006
2AWW
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SYNAPSE ASSOCIATED PROTEIN 97 PDZ2 DOMAIN VARIANT C378G WITH C-TERMINAL GLUR-A PEPTIDE
Descriptor:Synapse associated protein 97, 18-residue C-terminal peptide from glutamate receptor, ionotropic, ...
Authors:Von Ossowski, I., Oksanen, E., Von Ossowski, L., Cai, C., Sundberg, M., Goldman, A., Keinanen, K.
Deposit date:2005-09-02
Release date:2006-08-29
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (2.21 Å)
Cite:Crystal structure of the second PDZ domain of SAP97 in complex with a GluR-A C-terminal peptide
Febs J., 273, 2006
2AWX
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SYNAPSE ASSOCIATED PROTEIN 97 PDZ2 DOMAIN VARIANT C378S
Descriptor:Synapse associated protein 97, HISTIDINE
Authors:Von Ossowski, I., Oksanen, E., Von Ossowski, L., Cai, C., Sundberg, M., Goldman, A., Keinanen, K.
Deposit date:2005-09-02
Release date:2006-08-29
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure of the second PDZ domain of SAP97 in complex with a GluR-A C-terminal peptide
Febs J., 273, 2006
2G2L
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CRYSTAL STRUCTURE OF THE SECOND PDZ DOMAIN OF SAP97 IN COMPLEX WITH A GLUR-A C-TERMINAL PEPTIDE
Descriptor:Synapse-associated protein 97, 18-mer peptide from glutamate receptor, ionotropic, ...
Authors:Von Ossowski, I., Oksanen, E., Von Ossowski, L., Cai, C., Sundberg, M., Goldman, A., Keinanen, K.
Deposit date:2006-02-16
Release date:2006-08-29
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Crystal structure of the second PDZ domain of SAP97 in complex with a GluR-A C-terminal peptide
Febs J., 273, 2006
5GSK
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CRYSTAL STRUCTURE OF DUPLEX DNA3 IN COMPLEX WITH HG(II) AND SR(II)
Descriptor:DNA (5'-D(*GP*GP*TP*CP*GP*TP*CP*C)-3'), MERCURY (II) ION, STRONTIUM ION
Authors:Liu, H.H., Wang, R., Yao, Q.Q., Cheng, Y.Q., Yang, C., Luo, Q., Wu, B.X., Li, J.X., Ma, J.B., Sheng, J., Gan, J.H.
Deposit date:2016-08-16
Release date:2017-02-08
Last modified:2018-02-07
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:Flexibility and stabilization of HgII-mediated C:T and T:T base pairs in DNA duplex
Nucleic Acids Res., 45, 2017
2AEI
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CRYSTAL STRUCTURE OF A TERNARY COMPLEX OF FACTOR VIIA/TISSUE FACTOR AND 2-[[6-[3-(AMINOIMINOMETHYL)PHENOXY]-3,5-DIFLURO-4-[(1-METHYL-3-PHENYLPROPYL)AMINO]-2-PYRIDINYL]OXY]-BENZOIC ACID
Descriptor:Coagulation factor VII, Tissue factor, CALCIUM ION, ...
Authors:Adler, M., Whitlow, M.
Deposit date:2005-07-22
Release date:2006-08-01
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.52 Å)
Cite:The discovery of fluoropyridine-based inhibitors of the Factor VIIa/TF complex.
Bioorg.Med.Chem.Lett., 15, 2005
2G1N
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KETOPIPERAZINE-BASED RENIN INHIBITORS: OPTIMIZATION OF THE "C" RING
Descriptor:Renin, N-ACETYL-D-GLUCOSAMINE, N-{2-[6-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-2,2-DIMETHYL-3-OXO-2,3-DIHYDRO-4H-1,4-BENZOTHIAZIN-4-YL]ETHYL}ACETAMIDE
Authors:Holsworth, D.D.
Deposit date:2006-02-14
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Ketopiperazine-based renin inhibitors: Optimization of the "C" ring
BIOORG.MED.CHEM.LETT., 16, 2006
2G1O
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KETOPIPERAZINE-BASED RENIN INHIBITORS: OPTIMIZATION OF THE "C" RING
Descriptor:Renin, N-ACETYL-D-GLUCOSAMINE, 6-ETHYL-5-[9-(3-METHOXYPROPYL)-9H-CARBAZOL-2-YL]PYRIMIDINE-2,4-DIAMINE
Authors:Holsworth, D.D., Zhanga, E.
Deposit date:2006-02-14
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Ketopiperazine-Based Renin Inhibitors: Optimization of the "C" Ring
BIOORG.MED.CHEM.LETT., 16, 2006
2G1R
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KETOPIPERAZINE-BASED RENIN INHIBITORS: OPTIMIZATION OF THE C RING
Descriptor:Renin, N-ACETYL-D-GLUCOSAMINE, N-{2-[6-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-2,2-DIMETHYL-3-OXO-2,3-DIHYDRO-4H-1,4-BENZOXAZIN-4-YL]ETHYL}ACETAMIDE
Authors:Holsworth, D.D., Jalaiea, M., Zhanga, E., Mcconnella, P.
Deposit date:2006-02-14
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.42 Å)
Cite:Ketopiperazine-Based Renin Inhibitors: Optimization of the "C" Ring
BIOORG.MED.CHEM.LETT., 16, 2006
2G1S
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KETOPIPERAZINE-BASED RENIN INHIBITORS: OPTIMIZATION OF THE C RING
Descriptor:Renin, N-ACETYL-D-GLUCOSAMINE, (2S)-6-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-2-(3,5-DIFLUOROPHENYL)-4-(3-METHOXYPROPYL)-2H-1,4-BENZOXAZIN-3(4H)-ONE
Authors:Holsworth, D.D., Jalaiea, M., Zhanga, E., Mcconnella, P.
Deposit date:2006-02-14
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Ketopiperazine-Based Renin Inhibitors: Optimization of the "C" Ring
BIOORG.MED.CHEM.LETT., 16, 2006
2G1Y
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KETOPIPERAZINE-BASED RENIN INHIBITORS: OPTIMIZATION OF THE "C" RING
Descriptor:Renin, N-ACETYL-D-GLUCOSAMINE, 6-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-4-(3-METHOXYPROPYL)-2,2-DIMETHYL-2H-1,4-BENZOXAZIN-3(4H)-ONE
Authors:Holsworth, D.D., Jalaiea, M., Zhanga, E., Mcconnella, P.
Deposit date:2006-02-15
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Ketopiperazine-Based Renin Inhibitors: Optimization of the "C" Ring
BIOORG.MED.CHEM.LETT., 16, 2006
2G20
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KETOPIPERAZINE-BASED RENIN INHIBITORS: OPTIMIZATION OF THE C RING
Descriptor:Renin, N-(MORPHOLIN-4-YLSULFONYL)-L-PHENYLALANYL-3-(2-AMINO-1,3-THIAZOL-4-YL)-N-{(1R,2R,3S)-1-[(1R)-CYCLOHEX-3-EN-1-YLMETHYL]-2,3-DIHYDROXY-5-METHYLHEXYL}-L-ALANINAMIDE
Authors:Holsworth, D.D., Jalaiea, M., Zhanga, E., Mcconnella, P.
Deposit date:2006-02-15
Release date:2006-06-20
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Ketopiperazine-based renin inhibitors: optimization of the
Bioorg.Med.Chem.Lett., 16, 2006
2G21
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KETOPIPERAZINE-BASED RENIN INHIBITORS: OPTIMIZATION OF THE "C" RING
Descriptor:Renin, 7-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-1-(3-METHOXYPROPYL)QUINOLINIUM
Authors:Holsworth, D.D., Jalaiea, M., Zhanga, E., Mcconnella, P.
Deposit date:2006-02-15
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
2G22
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KETOPIPERAZINE-BASED RENIN INHIBITORS: OPTIMIZATION OF THE "C" RING
Descriptor:Renin, N-ACETYL-D-GLUCOSAMINE, 6-ETHYL-5-[1-(3-METHOXYPROPYL)-1,2,3,4-TETRAHYDROQUINOLIN-7-YL]-N~4~-(2-PHENYLETHYL)PYRIMIDINE-2,4-DIAMINE
Authors:Holsworth, D.D., Jalaiea, M., Zhanga, E., Mcconnella, P.
Deposit date:2006-02-15
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Ketopiperazine-Based Renin Inhibitors: Optimization of the "C" Ring
BIOORG.MED.CHEM.LETT., 16, 2006
2G24
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KETOPIPERAZINE-BASED RENIN INHIBITORS: OPTIMIZATION OF THE "C" RING
Descriptor:Renin, 5-{4-[(3,5-DIFLUOROBENZYL)AMINO]PHENYL}-6-ETHYLPYRIMIDINE-2,4-DIAMINE
Authors:Holsworth, D.D., Jalaiea, M., Zhanga, E., Mcconnella, P.
Deposit date:2006-02-15
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Ketopiperazine-Based Renin Inhibitors: Optimization of the C Ring
BIOORG.MED.CHEM.LETT., 16, 2006
2G26
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KETOPIPERAZINE-BASED RENIN INHIBITORS: OPTIMIZATION OF THE "C" RING
Descriptor:Renin, (5-{[(2R)-1-(4-{3-[(2-METHOXYBENZYL)OXY]PROPOXY}PHENYL)-6-OXOPIPERAZIN-2-YL]METHOXY}-1H-INDOL-1-YL)ACETIC ACID
Authors:Holsworth, D.D., Jalaiea, M., Zhanga, E., Mcconnella, P.
Deposit date:2006-02-15
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Ketopiperazine-Based Renin Inhibitors: Optimization of the "C" Ring
BIOORG.MED.CHEM.LETT., 16, 2006
2G27
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KETOPIPERAZINE-BASED RENIN INHIBITORS: OPTIMIZATION OF THE "C" RING
Descriptor:Renin, METHYL (6-{[(2R)-1-(4-{3-[(2-METHOXYBENZYL)OXY]PROPOXY}PHENYL)-6-OXOPIPERAZIN-2-YL]METHOXY}-1H-INDOL-1-YL)ACETATE
Authors:Holsworth, D.D., Jalaiea, M., Zhanga, E., Mcconnella, P.
Deposit date:2006-02-15
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Ketopiperazine-Based Renin Inhibitors: Optimization of the "C" Ring
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
5WSP
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CRYSTAL STRUCTURE OF DNA3 DUPLEX
Descriptor:DNA (5'-D(*GP*GP*TP*CP*GP*TP*CP*C)-3'), STRONTIUM ION
Authors:Gan, J.H., Liu, H.H.
Deposit date:2016-12-08
Release date:2017-02-08
Last modified:2017-08-30
Method:X-RAY DIFFRACTION (1.502 Å)
Cite:Flexibility and stabilization of HgII-mediated C:T and T:T base pairs in DNA duplex
Nucleic Acids Res., 45, 2017
5WSQ
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CRYSTAL STRUCTURE OF C-HG-T PAIR CONTAINING DNA DUPLEX
Descriptor:DNA (5'-D(*GP*CP*CP*CP*GP*TP*GP*C)-3'), MERCURY (II) ION, 1,3-PROPANDIOL
Authors:Gan, J.H., Liu, H.H.
Deposit date:2016-12-08
Release date:2017-02-08
Last modified:2017-08-30
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:Flexibility and stabilization of HgII-mediated C:T and T:T base pairs in DNA duplex
Nucleic Acids Res., 45, 2017
5WSR
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CRYSTAL STRUCTURE OF T-HG-T PAIR CONTAINING DNA DUPLEX
Descriptor:DNA (5'-D(*GP*GP*TP*CP*GP*TP*CP*C)-3'), MERCURY (II) ION
Authors:Gan, J.H., Liu, H.H.
Deposit date:2016-12-08
Release date:2017-02-08
Last modified:2017-08-30
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Flexibility and stabilization of HgII-mediated C:T and T:T base pairs in DNA duplex
Nucleic Acids Res., 45, 2017
5WSS
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CRYSTAL STRUCTURE OF T-HG-T PAIR CONTAINING DNA DUPLEX IN THE PRESENCE BA2+
Descriptor:DNA (5'-D(*GP*GP*TP*CP*GP*TP*CP*C)-3'), MERCURY (II) ION, BARIUM ION
Authors:Gan, J.H., Liu, H.H.
Deposit date:2016-12-08
Release date:2017-02-08
Last modified:2017-08-30
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Flexibility and stabilization of HgII-mediated C:T and T:T base pairs in DNA duplex
Nucleic Acids Res., 45, 2017
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
3N2N
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THE CRYSTAL STRUCTURE OF TUMOR ENDOTHELIAL MARKER 8 (TEM8) EXTRACELLULAR DOMAIN
Descriptor:Anthrax toxin receptor 1, ACETATE ION, MAGNESIUM ION
Authors:Fu, S., Tong, X.H., Wu, Y., Li, Y.Y., Rao, Z.H.
Deposit date:2010-05-18
Release date:2011-01-05
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:The structure of tumor endothelial marker 8 (TEM8) extracellular domain and implications for its receptor function for recognizing anthrax toxin.
Plos One, 5, 2010