Author results

2VYA
  • Download 2vya
  • View 2vya
Molmil generated image of 2vya
CRYSTAL STRUCTURE OF FATTY ACID AMIDE HYDROLASE CONJUGATED WITH THE DRUG-LIKE INHIBITOR PF-750
Descriptor:FATTY-ACID AMIDE HYDROLASE 1, UNKNOWN ATOM OR ION, 4-(quinolin-3-ylmethyl)piperidine-1-carboxylic acid, ...
Authors:Mileni, M., Johnson, D.S., Wang, Z., Everdeen, D.S., Liimatta, M., Pabst, B., Bhattacharya, K., Nugent, R.A., Kamtekar, S., Cravatt, B.F., Ahn, K., Stevens, R.C.
Deposit date:2008-07-22
Release date:2008-09-09
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.75 Å)
Cite:Structure-Guided Inhibitor Design for Human Faah by Interspecies Active Site Conversion.
Proc.Natl.Acad.Sci.USA, 105, 2008
1AG5
  • Download 1ag5
  • View 1ag5
Molmil generated image of 1ag5
THE SOLUTION STRUCTURE OF AN AFLATOXIN B1 EPOXIDE ADDUCT AT THE N7 POSITION OF GUANINE OPPOSITE AN ADENINE IN THE COMPLEMENTARY STRAND OF AN OLIGODEOXYNUCLEOTIDE DUPLEX, NMR, MINIMIZED AVERAGE STRUCTURE
Descriptor:DNA (5'-D(*CP*CP*AP*TP*CP*GP*AP*TP*CP*C)-3'), DNA (5'-D(*GP*GP*AP*TP*CP*AP*GP*AP*TP*GP*G)-3'), 8,9-DIHYDRO-9-HYDROXY-AFLATOXIN B1
Authors:Johnson, D.S., Stone, M.P.
Deposit date:1997-04-01
Release date:1997-09-17
Last modified:2019-01-30
Method:SOLUTION NMR
Cite:Refined solution structure of 8,9-dihydro-8-(N7-guanyl)-9-hydroxyaflatoxin B1 opposite CpA in the complementary strand of an oligodeoxynucleotide duplex as determined by 1H NMR.
Biochemistry, 34, 1995
2WAP
  • Download 2wap
  • View 2wap
Molmil generated image of 2wap
3D-CRYSTAL STRUCTURE OF HUMANIZED-RAT FATTY ACID AMIDE HYDROLASE (FAAH) CONJUGATED WITH THE DRUG-LIKE UREA INHIBITOR PF-3845
Descriptor:FATTY-ACID AMIDE HYDROLASE 1, 4-(3-{[5-(trifluoromethyl)pyridin-2-yl]oxy}benzyl)piperidine-1-carboxylic acid, CHLORIDE ION, ...
Authors:Mileni, M., Kamtekar, S., Stevens, R.C.
Deposit date:2009-02-11
Release date:2009-05-05
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Discovery and Characterization of a Highly Selective Faah Inhibitor that Reduces Inflammatory Pain.
Chem.Biol., 16, 2009
6AX1
  • Download 6ax1
  • View 6ax1
Molmil generated image of 6ax1
STRUCTURE OF HUMAN MONOACYLGLYCEROL LIPASE BOUND TO A COVALENT INHIBITOR
Descriptor:Monoglyceride lipase, 1,1,1,3,3,3-hexafluoropropan-2-yl 3-(3-phenyl-1,2,4-oxadiazol-5-yl)azetidine-1-carboxylate, GLYCEROL
Authors:Pandit, J.
Deposit date:2017-09-06
Release date:2017-12-27
Method:X-RAY DIFFRACTION (2.26 Å)
Cite:Azetidine and Piperidine Carbamates as Efficient, Covalent Inhibitors of Monoacylglycerol Lipase.
J. Med. Chem., 60, 2017
6BQ0
  • Download 6bq0
  • View 6bq0
Molmil generated image of 6bq0
STRUCTURE OF HUMAN MONOACYLGLYCEROL LIPASE BOUND TO A COVALENT INHIBITOR
Descriptor:Monoglyceride lipase, 1-({(1R,5S,6r)-6-[1-(4-fluorophenyl)-1H-pyrazol-3-yl]-3-azabicyclo[3.1.0]hexane-3-carbonyl}oxy)pyrrolidine-2,5-dione
Authors:Pandit, J.
Deposit date:2017-11-27
Release date:2018-03-14
Last modified:2018-04-25
Method:X-RAY DIFFRACTION (2 Å)
Cite:Discovery of Trifluoromethyl Glycol Carbamates as Potent and Selective Covalent Monoacylglycerol Lipase (MAGL) Inhibitors for Treatment of Neuroinflammation.
J. Med. Chem., 61, 2018
1DSI
  • Download 1dsi
  • View 1dsi
Molmil generated image of 1dsi
SOLUTION STRUCTURE OF A DUOCARMYCIN SA-INDOLE-ALKYLATED DNA DUPLEX
Descriptor:DNA (5'-D(*GP*AP*CP*TP*AP*AP*TP*TP*GP*AP*C)-3'), DNA (5'-D(*GP*TP*CP*AP*AP*TP*TP*AP*GP*TP*C)-3'), 4-HYDROXY-6-(1H-INDOLE-2-CARBONYL)-8-METHYL-3,6,7,8-TETRAHYDRO-3,6-DIAZA-AS-INDACENE-2-CARBOXYLIC ACID METHYL ESTER
Authors:Schnell, J.R., Ketchem, R.R., Boger, D.L., Chazin, W.J.
Deposit date:1998-07-29
Release date:1998-08-05
Last modified:2011-07-13
Method:SOLUTION NMR
Cite:Binding-Induced Activation of DNA Alkylation by Duocarmycin SA: Insights from the Structure of an Indole Derivative-DNA Adduct
J.Am.Chem.Soc., 121, 1999
1E74
  • Download 1e74
  • View 1e74
Molmil generated image of 1e74
NMR SOLUTION STRUCTURE OF ALPHA-CONOTOXIN IM1 POINT MUTATION VARIANT R11E
Descriptor:ALPHA-CONOTOXIN IM1(R11E)
Authors:Rogers, J.P., Luginbuhl, P., Pemberton, K., Harty, P., Wemmer, D.E., Stevens, R.C.
Deposit date:2000-08-24
Release date:2000-12-27
Last modified:2017-06-14
Method:SOLUTION NMR
Cite:Structure-Activity Relationships in a Peptidic Alpha7 Nicotinic Acetylcholine Receptor Antagonist
J.Mol.Biol., 304, 2000
1E75
  • Download 1e75
  • View 1e75
Molmil generated image of 1e75
NMR SOLUTION STRUCTURE OF ALPHA-CONOTOXIN IM1 POINT MUTATION VARIANT R7L
Descriptor:ALPHA-CONOTOXIN IM1(R7L)
Authors:Rogers, J.P., Luginbuhl, P., Pemberton, K., Harty, P., Wemmer, D.E., Stevens, R.C.
Deposit date:2000-08-24
Release date:2000-12-27
Last modified:2017-06-14
Method:SOLUTION NMR
Cite:Structure-Activity Relationships in a Peptidic Alpha7 Nicotinic Acetylcholine Receptor Antagonist
J.Mol.Biol., 304, 2000
1E76
  • Download 1e76
  • View 1e76
Molmil generated image of 1e76
NMR SOLUTION STRUCTURE OF ALPHA-CONOTOXIN IM1 POINT MUTATION VARIANT D5N
Descriptor:ALPHA-CONOTOXIN IM1(D5N)
Authors:Rogers, J.P., Luginbuhl, P., Pemberton, K., Harty, P., Wemmer, D.E., Stevens, R.C.
Deposit date:2000-08-24
Release date:2000-12-27
Last modified:2017-06-14
Method:SOLUTION NMR
Cite:Structure-Activity Relationships in a Peptidic Alpha7 Nicotinic Acetylcholine Receptor Antagonist
J.Mol.Biol., 304, 2000
1IM1
  • Download 1im1
  • View 1im1
Molmil generated image of 1im1
NMR SOLUTION STRUCTURE OF ALPHA-CONOTOXIN IM1, 20 STRUCTURES
Descriptor:ALPHA-CONOTOXIN IM1
Authors:Rogers, J.P., Luginbuhl, P., Shen, G.S., Mccabe, R.T., Stevens, R.C., Wemmer, D.E.
Deposit date:1998-11-18
Release date:1999-06-15
Last modified:2016-05-25
Method:SOLUTION NMR
Cite:NMR solution structure of alpha-conotoxin ImI and comparison to other conotoxins specific for neuronal nicotinic acetylcholine receptors.
Biochemistry, 38, 1999