Author results

1QGP
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NMR STRUCTURE OF THE Z-ALPHA DOMAIN OF ADAR1, 15 STRUCTURES
Descriptor:PROTEIN (DOUBLE STRANDED RNA ADENOSINE DEAMINASE)
Authors:Schade, M., Turner, C.J., Kuehne, R., Schmieder, P., Lowenhaupt, K., Herbert, A., Rich, A., Oschkinat, H.
Deposit date:1999-05-03
Release date:1999-10-19
Last modified:2011-07-13
Method:SOLUTION NMR
Cite:The solution structure of the Zalpha domain of the human RNA editing enzyme ADAR1 reveals a prepositioned binding surface for Z-DNA.
Proc.Natl.Acad.Sci.USA, 96, 1999
6I6C
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SEPIAPTERIN REDUCTASE IN COMPLEX WITH COMPOUND 2
Descriptor:Sepiapterin reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, (1~{R},2~{S},4~{S})-~{N}-(3-chloranyl-4-cyano-phenyl)sulfonylbicyclo[2.2.1]heptane-2-carboxamide, ...
Authors:Alen, J., Schade, M., Wagener, M., Blaesse, M.
Deposit date:2018-11-15
Release date:2019-07-10
Last modified:2019-07-24
Method:X-RAY DIFFRACTION (1.72 Å)
Cite:Fragment-Based Discovery of Novel Potent Sepiapterin Reductase Inhibitors.
J.Med.Chem., 62, 2019
6I6F
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SEPIAPTERIN REDUCTASE IN COMPLEX WITH COMPOUND 1
Descriptor:Sepiapterin reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ethyl 4-azanyl-3-bromanyl-benzoate, ...
Authors:Alen, J., Schade, M., Wagener, M., Blaesse, M.
Deposit date:2018-11-15
Release date:2019-07-10
Last modified:2019-07-24
Method:X-RAY DIFFRACTION (1.94 Å)
Cite:Fragment-Based Discovery of Novel Potent Sepiapterin Reductase Inhibitors.
J.Med.Chem., 62, 2019
6I6P
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SEPIAPTERIN REDUCTASE IN COMPLEX WITH COMPOUND 3
Descriptor:Sepiapterin reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 6-azaspiro[3.4]octan-6-yl-[2,4-bis(chloranyl)-6-oxidanyl-phenyl]methanone, ...
Authors:Alen, J., Schade, M., Wagener, M., Blaesse, M.
Deposit date:2018-11-15
Release date:2019-07-10
Last modified:2019-07-24
Method:X-RAY DIFFRACTION (1.62 Å)
Cite:Fragment-Based Discovery of Novel Potent Sepiapterin Reductase Inhibitors.
J.Med.Chem., 62, 2019
6I6T
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SEPIAPTERIN REDUCTASE IN COMPLEX WITH COMPOUND 5
Descriptor:Sepiapterin reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 4-bromanyl-1-oxidanyl-naphthalene-2-carboxylic acid, ...
Authors:Alen, J., Schade, M., Wagener, M., Blaesse, M.
Deposit date:2018-11-15
Release date:2019-07-10
Last modified:2019-07-24
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:Fragment-Based Discovery of Novel Potent Sepiapterin Reductase Inhibitors.
J.Med.Chem., 62, 2019
6I6V
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SEPIAPTERIN REDUCTASE IN COMPLEX WITH COMPOUND 6
Descriptor:Sepiapterin reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 2-[[(3~{R})-oxan-3-yl]methylsulfonyl]-2-azaspiro[4.5]decane, ...
Authors:Alen, J., Schade, M., Wagener, M., Blaesse, M.
Deposit date:2018-11-15
Release date:2019-07-10
Last modified:2019-07-24
Method:X-RAY DIFFRACTION (1.43 Å)
Cite:Fragment-Based Discovery of Novel Potent Sepiapterin Reductase Inhibitors.
J.Med.Chem., 62, 2019
6I79
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SEPIAPTERIN REDUCTASE IN COMPLEX WITH COMPOUND 4
Descriptor:Sepiapterin reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 6-[(4-~{tert}-butyl-1,3-thiazol-2-yl)methyl]-4,6-diazaspiro[2.4]heptane-5,7-dione
Authors:Alen, J., Schade, M., Wagener, M., Blaesse, M.
Deposit date:2018-11-16
Release date:2019-07-10
Last modified:2019-07-24
Method:X-RAY DIFFRACTION (1.63 Å)
Cite:Fragment-Based Discovery of Novel Potent Sepiapterin Reductase Inhibitors.
J.Med.Chem., 62, 2019
1XZ9
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STRUCTURE OF AF-6 PDZ DOMAIN
Descriptor:Afadin
Authors:Joshi, M., Boisguerin, P., Leitner, D., Volkmer-Engert, R., Moelling, K., Schade, M., Schmieder, P., Krause, G., Oschkinat, H.
Deposit date:2004-11-12
Release date:2005-11-15
Last modified:2011-07-13
Method:SOLUTION NMR
Cite:Discovery of low-molecular-weight ligands for the AF6 PDZ domain.
Angew.Chem.Int.Ed.Engl., 45, 2006
2EXG
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MAKING PROTEIN-PROTEIN INTERACTIONS DRUGABLE: DISCOVERY OF LOW-MOLECULAR-WEIGHT LIGANDS FOR THE AF6 PDZ DOMAIN
Descriptor:Afadin, (5R)-2-SULFANYL-5-[4-(TRIFLUOROMETHYL)BENZYL]-1,3-THIAZOL-4-ONE
Authors:Joshi, M., Vargas, C., Boisguerin, P., Krause, G., Schade, M., Oschkinat, H.
Deposit date:2005-11-08
Release date:2006-10-17
Last modified:2011-07-13
Method:SOLUTION NMR
Cite:Discovery of low-molecular-weight ligands for the AF6 PDZ domain.
Angew.Chem.Int.Ed.Engl., 45, 2006
1OYI
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SOLUTION STRUCTURE OF THE Z-DNA BINDING DOMAIN OF THE VACCINIA VIRUS GENE E3L
Descriptor:double-stranded RNA-binding protein
Authors:Kahmann, J.D., Wecking, D.A., Putter, V., Lowenhaupt, K., Kim, Y.-G., Schmieder, P., Oschkinat, H., Rich, A., Schade, M.
Deposit date:2003-04-04
Release date:2004-03-09
Last modified:2011-07-13
Method:SOLUTION NMR
Cite:The solution structure of the N-terminal domain of E3L shows a tyrosine conformation that may explain its reduced affinity to Z-DNA in vitro.
Proc.Natl.Acad.Sci.USA, 101, 2004
2LDA
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SOLUTION STRUCTURE OF THE ESTROGEN RECEPTOR-BINDING STAPLED PEPTIDE SP2 (AC-HKXLHQXLQDS-NH2)
Descriptor:Estrogen receptor-binding stapled peptide SP2
Authors:Phillips, C., Bazin, R., Bent, A., Davies, N., Moore, R., Pannifer, A., Pickford, A., Prior, S., Read, C., Roberts, L., Schade, M., Scott, A., Brown, D., Xu, B., Irving, S.
Deposit date:2011-05-20
Release date:2011-07-06
Last modified:2011-07-13
Method:SOLUTION NMR
Cite:Design and structure of stapled peptides binding to estrogen receptors.
J.Am.Chem.Soc., 133, 2011
2LDC
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SOLUTION STRUCTURE OF THE ESTROGEN RECEPTOR-BINDING STAPLED PEPTIDE SP1 (AC-HXILHXLLQDS-NH2)
Descriptor:Estrogen receptor-binding stapled peptide SP1
Authors:Phillips, C., Bazin, R., Bent, A., Davies, N., Moore, R., Pannifer, A., Pickford, A., Prior, S., Read, C., Roberts, L., Schade, M., Scott, A., Brown, D., Xu, B., Irving, S.
Deposit date:2011-05-20
Release date:2011-07-06
Last modified:2011-07-13
Method:SOLUTION NMR
Cite:Design and structure of stapled peptides binding to estrogen receptors.
J.Am.Chem.Soc., 133, 2011
2LDD
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SOLUTION STRUCTURE OF THE ESTROGEN RECEPTOR-BINDING STAPLED PEPTIDE SP6 (AC-EKHKILXRLLXDS-NH2)
Descriptor:Estrogen receptor-binding stapled peptide SP6
Authors:Phillips, C., Bazin, R., Bent, A., Davies, N., Moore, R., Pannifer, A., Pickford, A., Prior, S., Read, C., Roberts, L., Schade, M., Scott, A., Brown, D., Xu, B., Irving, S.
Deposit date:2011-05-21
Release date:2011-07-06
Last modified:2011-07-13
Method:SOLUTION NMR
Cite:Design and structure of stapled peptides binding to estrogen receptors.
J.Am.Chem.Soc., 133, 2011
2YJA
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STAPLED PEPTIDES BINDING TO ESTROGEN RECEPTOR ALPHA.
Descriptor:STAPLED PEPTIDE, ESTROGEN RECEPTOR, ESTRADIOL
Authors:Phillips, C., Roberts, L.R., Schade, M., Bazin, R., Bent, A., Davies, N.L., Irving, S.L., Moore, R., Pannifer, A.D., Brown, D.G., Pickford, A.R., Scott, A., Xu, B.
Deposit date:2011-05-19
Release date:2011-08-03
Method:X-RAY DIFFRACTION (1.82 Å)
Cite:Design and Structure of Stapled Peptides Binding to Estrogen Receptors.
J.Am.Chem.Soc., 133, 2011
2YJD
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STAPLED PEPTIDE BOUND TO ESTROGEN RECEPTOR BETA
Descriptor:ESTROGEN RECEPTOR BETA, STAPLED PEPTIDE, 4-(2-PROPAN-2-YLOXYBENZIMIDAZOL-1-YL)PHENOL
Authors:Phillips, C., Roberts, L.R., Schade, M., Bent, A., Davies, N.L., Moore, R., Pannifer, A.D., Brown, D.G., Pickford, A.R., Irving, S.L.
Deposit date:2011-05-19
Release date:2011-08-03
Last modified:2017-01-25
Method:X-RAY DIFFRACTION (1.93 Å)
Cite:Design and Structure of Stapled Peptides Binding to Estrogen Receptors.
J.Am.Chem.Soc., 133, 2011
3GOK
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BINDING SITE MAPPING OF PROTEIN LIGANDS
Descriptor:MAP kinase-activated protein kinase 2, 2-(2-QUINOLIN-3-YLPYRIDIN-4-YL)-1,5,6,7-TETRAHYDRO-4H-PYRROLO[3,2-C]PYRIDIN-4-ONE
Authors:Scheich, C.
Deposit date:2009-03-19
Release date:2010-03-02
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:Binding site mapping of protein ligands
To be published