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1G27
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CRYSTAL STRUCTURE OF E.COLI POLYPEPTIDE DEFORMYLASE COMPLEXED WITH THE INHIBITOR BB-3497
Descriptor:POLYPEPTIDE DEFORMYLASE, NICKEL (II) ION, 2-[(FORMYL-HYDROXY-AMINO)-METHYL]-HEXANOIC ACID (1-DIMETHYLCARBAMOYL-2,2-DIMETHYL-PROPYL)-AMIDE
Authors:Clements, J.M., Beckett, P., Brown, A., Catlin, C., Lobell, M., Palan, S., Thomas, W., Whittaker, M., Baker, P.J., Rodgers, H.F., Barynin, V., Rice, D.W., Hunter, M.G.
Deposit date:2000-10-17
Release date:2001-10-17
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Antibiotic activity and characterization of BB-3497, a novel peptide deformylase inhibitor.
Antimicrob.Agents Chemother., 45, 2001
1G2A
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THE CRYSTAL STRUCTURE OF E.COLI PEPTIDE DEFORMYLASE COMPLEXED WITH ACTINONIN
Descriptor:POLYPEPTIDE DEFORMYLASE, NICKEL (II) ION, ACTINONIN
Authors:Clements, J.M., Beckett, P., Brown, A., Catlin, C., Lobell, M., Palan, S., Thomas, W., Whittaker, M., Baker, P.J., Rodgers, H.F., Barynin, V., Rice, D.W., Hunter, M.G.
Deposit date:2000-10-18
Release date:2001-10-17
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Antibiotic activity and characterization of BB-3497, a novel peptide deformylase inhibitor.
Antimicrob.Agents Chemother., 45, 2001
6G5F
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CRYSTAL STRUCTURE OF AN ENGINEERED BOTULINUM NEUROTOXIN TYPE B MUTANT E1191M/S1199Y IN COMPLEX WITH HUMAN SYNAPTOTAGMIN 1
Descriptor:Botulinum neurotoxin type B, Synaptotagmin-1, GLYCEROL, ...
Authors:Masuyer, G., Elliot, M., Favre-Guilmard, C., Liu, S.M., Maignel, J., Beard, M., Carre, D., Kalinichev, M., Lezmi, S., Mir, I., Nicoleau, C., Palan, S., Perier, C., Raban, E., Dong, M., Krupp, J., Stenmark, P.
Deposit date:2018-03-29
Release date:2019-01-16
Last modified:2019-02-20
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Engineered botulinum neurotoxin B with improved binding to human receptors has enhanced efficacy in preclinical models.
Sci Adv, 5, 2019
6G5G
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CRYSTAL STRUCTURE OF AN ENGINEERED BOTULINUM NEUROTOXIN TYPE B MUTANT E1191M/S1199Y IN COMPLEX WITH HUMAN SYNAPTOTAGMIN 2
Descriptor:Botulinum neurotoxin type B, Synaptotagmin 2, MAGNESIUM ION, ...
Authors:Masuyer, G., Elliot, M., Favre-Guilmard, C., Liu, S.M., Maignel, J., Beard, M., Carre, D., Kalinichev, M., Lezmi, S., Mir, I., Nicoleau, C., Palan, S., Perier, C., Raban, E., Dong, M., Krupp, J., Stenmark, P.
Deposit date:2018-03-29
Release date:2019-01-16
Last modified:2019-02-20
Method:X-RAY DIFFRACTION (2 Å)
Cite:Engineered botulinum neurotoxin B with improved binding to human receptors has enhanced efficacy in preclinical models.
Sci Adv, 5, 2019
6G5K
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CRYSTAL STRUCTURE OF THE BINDING DOMAIN OF BOTULINUM NEUROTOXIN TYPE B IN COMPLEX WITH HUMAN SYNAPTOTAGMIN 1
Descriptor:Botulinum neurotoxin type B, Synaptotagmin-1
Authors:Masuyer, G., Elliot, M., Favre-Guilmard, C., Liu, S.M., Maignel, J., Beard, M., Carre, D., Kalinichev, M., Lezmi, S., Mir, I., Nicoleau, C., Palan, S., Perier, C., Raban, E., Dong, M., Krupp, J., Stenmark, P.
Deposit date:2018-03-29
Release date:2019-01-16
Last modified:2019-02-20
Method:X-RAY DIFFRACTION (2 Å)
Cite:Engineered botulinum neurotoxin B with improved binding to human receptors has enhanced efficacy in preclinical models.
Sci Adv, 5, 2019
3FHR
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HIGH RESOLUTION CRYSTAL STRUCTURE OF MITOGEN-ACTIVATED PROTEIN KINASE-ACTIVATED PROTEIN KINASE 3 (MK3)-INHIBITOR COMPLEX
Descriptor:MAP kinase-activated protein kinase 3, 2-(2-QUINOLIN-3-YLPYRIDIN-4-YL)-1,5,6,7-TETRAHYDRO-4H-PYRROLO[3,2-C]PYRIDIN-4-ONE
Authors:Cheng, R.K.Y., Barker, J., Palan, S., Felicetti, B., Whittaker, M., Hesterkamp, T.
Deposit date:2008-12-10
Release date:2009-12-15
Last modified:2014-01-29
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:High-resolution crystal structure of human Mapkap kinase 3 in complex with a high affinity ligand
Protein Sci., 19, 2010
3FXW
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HIGH RESOLUTION CRYSTAL STRUCTURE OF MITOGEN-ACTIVATED PROTEIN KINASE-ACTIVATED PROTEIN KINASE 3/INHIBITOR 2 COMPLEX
Descriptor:MAP kinase-activated protein kinase 3, 2-[2-(2-FLUOROPHENYL)PYRIDIN-4-YL]-1,5,6,7-TETRAHYDRO-4H-PYRROLO[3,2-C]PYRIDIN-4-ONE
Authors:Cheng, R.K.Y., Barker, J., Palan, S., Felicetti, B., Whittaker, M., Hesterkamp, T.
Deposit date:2009-01-21
Release date:2010-01-26
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:High resolution crystal structure of mitogen-activated protein kinase-activated protein kinase 3/inhibitor 2 complex
To be Published
3HYY
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CRYSTAL STRUCTURE OF HSP90 WITH FRAGMENT 37-D04
Descriptor:Heat shock protein HSP 90-alpha, methyl 5-furan-2-yl-3-methyl-1H-pyrazole-4-carboxylate
Authors:Barker, J., Mather, O., Cheng, R.K.Y., Palan, S., Felicetti, B., Whittaker, M.
Deposit date:2009-06-23
Release date:2010-07-14
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal structure of Hsp90 with fragment 37-D04
TO BE PUBLISHED
3HYZ
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CRYSTAL STRUCTURE OF HSP90 WITH FRAGMENT 42-C03
Descriptor:Heat shock protein HSP 90-alpha, N,N-dimethyl-7H-purin-6-amine
Authors:Barker, J., Mather, O., Cheng, R.K.Y., Palan, S., Felicetti, B., Whittaker, M.
Deposit date:2009-06-23
Release date:2010-07-14
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structure of Hsp90 with fragment 42-C03
TO BE PUBLISHED
3HZ1
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CRYSTAL STRUCTURE OF HSP90 WITH FRAGMENTS 37-D04 AND 42-C03
Descriptor:Heat shock protein HSP 90-alpha, N,N-dimethyl-7H-purin-6-amine, methyl 5-furan-2-yl-3-methyl-1H-pyrazole-4-carboxylate
Authors:Barker, J., Mather, O., Cheng, R.K.Y., Palan, S., Felicetti, B., Whittaker, M.
Deposit date:2009-06-23
Release date:2010-07-14
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structure of Hsp90 with fragments 37-D04 and 42-C03
TO BE PUBLISHED
3HZ5
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CRYSTAL STRUCTURE OF HSP90 WITH FRAGMENT Z064
Descriptor:Heat shock protein HSP 90-alpha, N-[4-(5-furan-2-yl-3-methyl-1H-pyrazol-4-yl)butyl]-N-methyl-7H-purin-6-amine
Authors:Barker, J., Mather, O., Cheng, R.K.Y., Palan, S., Felicetti, B., Whittaker, M.
Deposit date:2009-06-23
Release date:2010-07-14
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal structure of Hsp90 with fragment Z064
to be published
3FT5
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STRUCTURE OF HSP90 BOUND WITH A NOVEL FRAGMENT
Descriptor:Heat shock protein HSP 90-alpha, 4-methyl-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-2-amine
Authors:Barker, J.B., Mather, O., Cheng, R.K.Y., Palan, S., Felicetti, B.
Deposit date:2009-01-12
Release date:2009-05-05
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Fragment-based Identification of Hsp90 Inhibitors.
Chemmedchem, 4, 2009
3FT8
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STRUCTURE OF HSP90 BOUND WITH A NOVAL FRAGMENT.
Descriptor:Heat shock protein HSP 90-alpha, (5E,7S)-2-amino-7-(4-fluoro-2-pyridin-3-ylphenyl)-4-methyl-7,8-dihydroquinazolin-5(6H)-one oxime
Authors:Barker, J.B., Cheng, R.K.Y., Palan, S., Felicetti, B.
Deposit date:2009-01-12
Release date:2009-06-30
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Fragment-based identification of Hsp90 inhibitors.
Chemmedchem, 4, 2009