Author results

1RCY
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RUSTICYANIN (RC) FROM THIOBACILLUS FERROOXIDANS
Descriptor:RUSTICYANIN, COPPER (II) ION
Authors:Walter, R.L., Friedman, A.M., Ealick, S.E., Blake II, R.C., Proctor, P., Shoham, M.
Deposit date:1996-04-10
Release date:1997-05-15
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Multiple wavelength anomalous diffraction (MAD) crystal structure of rusticyanin: a highly oxidizing cupredoxin with extreme acid stability.
J.Mol.Biol., 263, 1996
2GKO
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S41 PSYCHROPHILIC PROTEASE
Descriptor:microbial serine proteinases; subtilisin, CALCIUM ION, SODIUM ION, ...
Authors:Walter, R.L., Mekel, M.J., Grayling, R.A., Arnold, F.H., Wintrode, P.L., Almog, O.
Deposit date:2006-04-03
Release date:2007-05-01
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:The crystal structures of the psychrophilic subtilisin S41 and the mesophilic subtilisin Sph reveal the same calcium-loaded state.
Proteins, 74, 2009
2GTM
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MUTATED MOUSE P38 MAP KINASE DOMAIN IN COMPLEX WITH INHIBITOR PG-892579
Descriptor:Mitogen-activated protein kinase 14, 8-(2-CHLOROPHENYLAMINO)-2-(2,6-DIFLUOROPHENYLAMINO)-9-ETHYL-9H-PURINE-1,7-DIIUM
Authors:Walter, R.L., Mekel, M.J., Evdokimov, A.G., Pokross, M.E., Sabat, M.
Deposit date:2006-04-28
Release date:2006-05-23
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:The development of novel C-2, C-8, and N-9 trisubstituted purines as inhibitors of TNF-alpha production.
Bioorg.Med.Chem.Lett., 16, 2006
2GTN
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MUTATED MAP KINASE P38 (MUS MUSCULUS) IN COMPLEX WITH INHBITOR PG-951717
Descriptor:Mitogen-activated protein kinase 14, SULFATE ION, 2-(2,6-DIFLUOROPHENOXY)-N-(2-FLUOROPHENYL)-9-ISOPROPYL-9H-PURIN-8-AMINE
Authors:Walter, R.L., Mekel, M.J., Evdokimov, A.G., Pokross, M.E., Sabat, M.
Deposit date:2006-04-28
Release date:2006-07-11
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:The development of novel C-2, C-8, and N-9 trisubstituted purines as inhibitors of TNF-alpha production.
Bioorg.Med.Chem.Lett., 16, 2006
2HK5
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HCK KINASE IN COMPLEX WITH LCK TARGETTED INHIBITOR PG-1009247
Descriptor:Tyrosine-protein kinase HCK, 3-{[2-(1H-BENZIMIDAZOL-1-YL)-6-{[2-(DIETHYLAMINO)ETHYL]AMINO}PYRIMIDIN-4-YL]AMINO}-4-METHYLPHENOL
Authors:Walter, R.L., Mekel, M.J., Evdokimov, A.G., Pokross, M.E., Sabat, M.P.
Deposit date:2006-07-03
Release date:2006-09-05
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (2 Å)
Cite:The development of 2-benzimidazole substituted pyrimidine based inhibitors of lymphocyte specific kinase (Lck).
Bioorg.Med.Chem.Lett., 16, 2006
1DL5
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PROTEIN-L-ISOASPARTATE O-METHYLTRANSFERASE
Descriptor:PROTEIN-L-ISOASPARTATE O-METHYLTRANSFERASE, CADMIUM ION, CHLORIDE ION, ...
Authors:Skinner, M.M., Puvathingal, J.M., Walter, R.L., Friedman, A.M.
Deposit date:1999-12-08
Release date:2000-12-08
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure of protein isoaspartyl methyltransferase: a catalyst for protein repair.
Structure Fold.Des., 8, 2000
1FG9
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3:1 COMPLEX OF INTERFERON-GAMMA RECEPTOR WITH INTERFERON-GAMMA DIMER
Descriptor:INTERFERON GAMMA, INTERFERON-GAMMA RECEPTOR ALPHA CHAIN
Authors:Thiel, D.J., le Du, M.-H., Walter, R.L., D'Arcy, A., Chene, C., Fountoulakis, M., Garotta, G., Winkler, F.K., Ealick, S.E.
Deposit date:2000-07-28
Release date:2000-08-11
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Observation of an unexpected third receptor molecule in the crystal structure of human interferon-gamma receptor complex.
Structure Fold.Des., 8, 2000
1YW2
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MUTATED MUS MUSCULUS P38 KINASE (MP38)
Descriptor:Mitogen-activated protein kinase 14, 2-(ETHOXYMETHYL)-4-(4-FLUOROPHENYL)-3-[2-(2-HYDROXYPHENOXY)PYRIMIDIN-4-YL]ISOXAZOL-5(2H)-ONE
Authors:Laughlin, S.K., Clark, M.P., Djung, J.F., Golebiowski, A., Brugel, T.A., Sabat, M., Bookland, R.G., Laufersweiler, M.J., Vanrens, J.C., Townes, J.A., De, B., Hsieh, L.C., Xu, S.C., Walter, R.L., Mekel, M.J., Janusz, M.J.
Deposit date:2005-02-16
Release date:2005-05-10
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (2.01 Å)
Cite:The development of new isoxazolone based inhibitors of tumor necrosis factor-alpha (TNF-alpha) production.
Bioorg.Med.Chem.Lett., 15, 2005
1YWR
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CRYSTAL STRUCTURE ANALYSIS OF INACTIVE P38 KINASE DOMAIN IN COMPLEX WITH A MONOCYCLIC PYRAZOLONE INHIBITOR
Descriptor:Mitogen-activated protein kinase 14, 4-(4-FLUOROPHENYL)-1-METHYL-5-(2-{[(1S)-1-PHENYLETHYL]AMINO}PYRIMIDIN-4-YL)-2-PIPERIDIN-4-YL-1,2-DIHYDRO-3H-PYRAZOL-3-ONE
Authors:Golebiowski, A., Townes, J.A., Laufersweiler, M.J., Brugel, T.A., Clark, M.P., Clark, C.M., Djung, J.F., Laughlin, S.K., Sabat, M.P., Bookland, R.G., Vanrens, J.C., De, B., Hsieh, L.C., Janusz, M.J., Walter, R.L., Webster, M.E., Mekel, M.J.
Deposit date:2005-02-18
Release date:2005-05-10
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:The development of monocyclic pyrazolone based cytokine synthesis inhibitors.
Bioorg.Med.Chem.Lett., 15, 2005
2GG0
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NOVEL BACTERIAL METHIONINE AMINOPEPTIDASE INHIBITORS
Descriptor:Methionine aminopeptidase, COBALT (II) ION, SODIUM ION, ...
Authors:Evdokimov, A.G., Pokross, M.E., Walter, R.L., Mekel, M.
Deposit date:2006-03-23
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.28 Å)
Cite:Serendipitous discovery of novel bacterial methionine aminopeptidase inhibitors.
Proteins, 66, 2007
2GG2
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NOVEL BACTERIAL METHIONINE AMINOPEPTIDASE INHIBITORS
Descriptor:Methionine aminopeptidase, COBALT (II) ION, SODIUM ION, ...
Authors:Evdokimov, A.G., Pokross, M.E., Walter, R.L., Mekel, M.
Deposit date:2006-03-23
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1 Å)
Cite:Serendipitous discovery of novel bacterial methionine aminopeptidase inhibitors.
Proteins, 66, 2007
2GG3
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NOVEL BACTERIAL METHIONINE AMINOPEPTIDASE INHIBITORS
Descriptor:Methionine aminopeptidase, COBALT (II) ION, SODIUM ION, ...
Authors:Evdokimov, A.G., Pokross, M.E., Walter, R.L., Mekel, M.
Deposit date:2006-03-23
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Serendipitous discovery of novel bacterial methionine aminopeptidase inhibitors.
Proteins, 66, 2007
2GG5
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NOVEL BACTERIAL METHIONINE AMINOPEPTIDASE INHIBITORS
Descriptor:Methionine aminopeptidase, COBALT (II) ION, SODIUM ION, ...
Authors:Evdokimov, A.G., Pokross, M.E., Walter, R.L., Mekel, M.
Deposit date:2006-03-23
Release date:2006-06-13
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (2.12 Å)
Cite:Serendipitous discovery of novel bacterial methionine aminopeptidase inhibitors.
Proteins, 66, 2007
2GG7
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NOVEL BACTERIAL METHIONINE AMINOPEPTIDASE INHIBITORS
Descriptor:Methionine aminopeptidase, COBALT (II) ION, SODIUM ION, ...
Authors:Evdokimov, A.G., Pokross, M.E., Walter, R.L., Mekel, M.
Deposit date:2006-03-23
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.12 Å)
Cite:Serendipitous discovery of novel bacterial methionine aminopeptidase inhibitors.
Proteins, 66, 2007
2GG8
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NOVEL BACTERIAL METHIONINE AMINOPEPTIDASE INHIBITORS
Descriptor:Methionine aminopeptidase, COBALT (II) ION, SODIUM ION, ...
Authors:Evdokimov, A.G., Pokross, M.E., Walter, R.L., Mekel, M.
Deposit date:2006-03-23
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Serendipitous discovery of novel bacterial methionine aminopeptidase inhibitors.
Proteins, 66, 2007
2GG9
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NOVEL BACTERIAL METHIONINE AMINOPEPTIDASE INHIBITORS
Descriptor:Methionine aminopeptidase, COBALT (II) ION, SODIUM ION, ...
Authors:Evdokimov, A.G., Pokross, M.E., Walter, R.L., Mekel, M.
Deposit date:2006-03-23
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:Serendipitous discovery of novel bacterial methionine aminopeptidase inhibitors.
Proteins, 66, 2007
2GGB
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NOVEL BACTERIAL METHIONINE AMINOPEPTIDASE INHIBITORS
Descriptor:Methionine aminopeptidase, COBALT (II) ION, SODIUM ION, ...
Authors:Evdokimov, A.G., Pokross, M.E., Walter, R.L., Mekel, M.
Deposit date:2006-03-23
Release date:2006-06-13
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (2.13 Å)
Cite:Serendipitous discovery of novel bacterial methionine aminopeptidase inhibitors.
Proteins, 66, 2007
2GGC
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NOVEL BACTERIAL METHIONINE AMINOPEPTIDASE INHIBITORS
Descriptor:Methionine aminopeptidase, COBALT (II) ION, SODIUM ION, ...
Authors:Evdokimov, A.G., Pokross, M.E., Walter, R.L., Mekel, M.
Deposit date:2006-03-23
Release date:2006-06-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1 Å)
Cite:Serendipitous discovery of novel bacterial methionine aminopeptidase inhibitors.
Proteins, 66, 2007
2HBT
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CRYSTAL STRUCTURE OF HIF PROLYL HYDROXYLASE EGLN-1 IN COMPLEX WITH A BIOLOGICALLY ACTIVE INHIBITOR
Descriptor:Egl nine homolog 1, FE (II) ION, N-[(1-CHLORO-4-HYDROXYISOQUINOLIN-3-YL)CARBONYL]GLYCINE
Authors:Evdokimov, A.G., Walter, R.L., Mekel, M., Pokross, M.E., Kawamoto, R., Boyer, A.
Deposit date:2006-06-14
Release date:2006-06-27
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Crystal structure of HIF prolyl hydroxylase in complex with a biologically active inhibitor
To be Published
2HBU
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CRYSTAL STRUCTURE OF HIF PROLYL HYDROXYLASE EGLN-1 IN COMPLEX WITH A BIOLOGICALLY ACTIVE INHIBITOR
Descriptor:Egl nine homolog 1, FE (II) ION, N-[(1-CHLORO-4-HYDROXYISOQUINOLIN-3-YL)CARBONYL]GLYCINE
Authors:Evdokimov, A.G., Walter, R.L., Mekel, M., Pokross, M.E., Kawamoto, R., Boyer, A.
Deposit date:2006-06-14
Release date:2006-06-27
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Crystal structure of HIF prolyl hydroxylase in complex with a biologically active inhibitor
To be Published
2ZNW
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CRYSTAL STRUCTURE OF SCFV10 IN COMPLEX WITH HEN EGG LYSOZYME
Descriptor:ScFv10, Lysozyme C, 2-(2-{2-[2-(2-METHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL
Authors:DeSantis, M.E., Acchione, M., Li, M., Walter, R.L., Wlodawer, A., Smith-Gill, S.
Deposit date:2008-05-02
Release date:2009-01-27
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (2.71 Å)
Cite:Specific fluorine labeling of the HyHEL10 antibody affects antigen binding and dynamics
Biochemistry, 51, 2012
2ZNX
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5-FLUOROTRYPTOPHAN INCORPORATED SCFV10 COMPLEXED TO HEN EGG LYSOZYME
Descriptor:ScFv, Lysozyme C, 2-(2-{2-[2-(2-METHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL
Authors:DeSantis, M.E., Acchione, M., Li, M., Walter, R.L., Wlodawer, A., Smith-Gill, S.
Deposit date:2008-05-02
Release date:2009-01-27
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Specific fluorine labeling of the HyHEL10 antibody affects antigen binding and dynamics
Biochemistry, 51, 2012
3SD0
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IDENTIFICATION OF A GLYCOGEN SYNTHASE KINASE-3B INHIBITOR THAT ATTENUATES HYPERACTIVITY IN CLOCK MUTANT MICE
Descriptor:Glycogen synthase kinase-3 beta, 3-(5-fluoro-6-iodo-1-methyl-1H-indol-3-yl)-4-(7-methoxy-1-benzofuran-3-yl)-1H-pyrrole-2,5-dione, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID
Authors:Mesecar, A.M., Walters, R.L.
Deposit date:2011-06-08
Release date:2011-08-03
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Identification of a Glycogen Synthase Kinase-3b Inhibitor that Attenuates Hyperactivity in CLOCK Mutant Mice
To be Published
4KFA
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CRYSTAL STRUCTURE OF HUMAN FARNESYL PYROPHOSPHATE SYNTHASE (T201A MUTANT) COMPLEXED WITH MG AND ZOLEDRONATE
Descriptor:Farnesyl pyrophosphate synthase, MAGNESIUM ION, ZOLEDRONIC ACID, ...
Authors:Barnett, B.L., Tsoumpra, M.K., Muniz, J.R.C., Walter, R.L.
Deposit date:2013-04-26
Release date:2014-04-30
Method:X-RAY DIFFRACTION (1.98 Å)
Cite:Crystal structure of human farnesyl pyrophosphate synthase (t201a mutant) complexed with mg and zoledronate
To be Published
4KPD
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CRYSTAL STRUCTURE OF HUMAN FARNESYL PYROPHOSPHATE SYNTHASE (Y204F) MUTANT COMPLEXED WITH MG, RISEDRONATE AND ISOPENTENYL PYROPHOSPHATE
Descriptor:Farnesyl pyrophosphate synthase, MAGNESIUM ION, 3-METHYLBUT-3-ENYL TRIHYDROGEN DIPHOSPHATE, ...
Authors:Barnett, B.L., Tsoumpra, M.K., Muniz, J.R.C., Walter, R.L.
Deposit date:2013-05-13
Release date:2014-04-30
Method:X-RAY DIFFRACTION (1.96 Å)
Cite:Crystal Structure of Human Farnesyl Pyrophosphate Synthase (Y204F) Mutant Complexed with Mg, Risedronate and Isopentenyl Pyrophosphate
To be Published
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