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PDB: 28 results

5DFS
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BU of 5dfs by Molmil
Crystal structure of Spider Monkey Cytochrome C at 1.15 Angstrom
Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, Cytochrome c, ...
Authors:MOU, T.C, McClelland, L.J, Jeakins-Cooley, M.E, Goldes, M.E, SPRANG, S.R, BOWLER, B.E.
Deposit date:2015-08-27
Release date:2016-03-02
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (1.15 Å)
Cite:Disruption of a hydrogen bond network in human versus spider monkey cytochrome c affects heme crevice stability.
J.Inorg.Biochem., 158, 2016
6D8X
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BU of 6d8x by Molmil
PPAR gamma LBD complexed with the agonist GW1929
Descriptor: (2~{S})-3-[4-[2-[methyl(pyridin-2-yl)amino]ethoxy]phenyl]-2-[[2-(phenylcarbonyl)phenyl]amino]propanoic acid, CITRATE ANION, GLYCEROL, ...
Authors:Mou, T.C, Chrisman, I.M, Hughes, T.S, Sprang, S.R.
Deposit date:2018-04-27
Release date:2019-05-01
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:PPAR gamma LBD complexed with the agonist GW1929
To Be Published
6DBH
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BU of 6dbh by Molmil
Crystal structure of PPAR gamma in complex with NMP422
Descriptor: 4-{2-[(2,3-dioxo-1-pentyl-2,3-dihydro-1H-indol-5-yl)sulfanyl]ethyl}benzoic acid, CHLORIDE ION, Peroxisome proliferator-activated receptor gamma
Authors:Mou, T.C, Chrisman, I.M, Hughes, T.S, Sprang, S.R.
Deposit date:2018-05-03
Release date:2019-05-08
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.597 Å)
Cite:Crystal structure of PPAR gamma in complex with NMP422
To Be Published
6DCU
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BU of 6dcu by Molmil
Crystal structure of PPAR gamma co-crystallized with nTZDpa
Descriptor: 5-CHLORO-1-(4-CHLOROBENZYL)-3-(PHENYLTHIO)-1H-INDOLE-2-CARBOXYLIC ACID, Peroxisome proliferator-activated receptor gamma
Authors:Mou, T.C, Chrisman, I.M, Hughes, T.S, Sprang, S.R.
Deposit date:2018-05-08
Release date:2019-05-15
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.95 Å)
Cite:Crystal structure of PPAR gamma in complex with NMP422
To Be Published
6D94
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BU of 6d94 by Molmil
Crystal structure of PPAR gamma in complex with Mediator of RNA polymerase II transcription subunit 1
Descriptor: (2~{S})-3-[4-[2-[methyl(pyridin-2-yl)amino]ethoxy]phenyl]-2-[[2-(phenylcarbonyl)phenyl]amino]propanoic acid, Mediator of RNA polymerase II transcription subunit 1, Peroxisome proliferator-activated receptor gamma
Authors:Mou, T.C, Chrisman, I.M, Hughes, T.S, Sprang, S.R.
Deposit date:2018-04-27
Release date:2019-05-01
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:A structural mechanism of nuclear receptor biased agonism.
Proc.Natl.Acad.Sci.USA, 119, 2022
6XAZ
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BU of 6xaz by Molmil
Structure of the PR domain from human PRDM5
Descriptor: DI(HYDROXYETHYL)ETHER, PR domain zinc finger protein 5
Authors:Mou, T.C, Kerchner, K.M, Sprang, S.R, Briknarova, K.
Deposit date:2020-06-05
Release date:2021-06-09
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structure of the PR domain from human PRDM5
To Be Published
6XAX
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BU of 6xax by Molmil
Structure of a fragment of human fibronectin containing the 11th type III domain, extra domain A, and the 12th type III domain
Descriptor: Fibronectin, GLYCEROL
Authors:Mou, T.C, Nepomuceno, P.A, Sprang, S.R, Briknarova, K.
Deposit date:2020-06-04
Release date:2021-06-09
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Fragment of human fibronectin containing the 11th type III domain, extra domain A, and 12th type III domain
To Be Published
6XAY
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BU of 6xay by Molmil
Structure of a fragment of human fibronectin containing the 10th, 11th and 12th type III domains
Descriptor: Fibronectin, GLYCEROL
Authors:Mou, T.C, Nepomuceno, P.A, Sprang, S.R, Briknarova, K.
Deposit date:2020-06-05
Release date:2021-06-09
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.48 Å)
Cite:Fragment of human fibronectin containing the 10th, 11th and 12th type III domains
To Be Published
5TY3
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BU of 5ty3 by Molmil
Crystal structure of K72A variant of Human Cytochrome c
Descriptor: Cytochrome c, HEME C, SULFATE ION
Authors:Mou, T.C, Nold, S.M, Lei, H, Sprang, S.R, Bowler, B.E.
Deposit date:2016-11-18
Release date:2017-09-06
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Effect of a K72A Mutation on the Structure, Stability, Dynamics, and Peroxidase Activity of Human Cytochrome c.
Biochemistry, 56, 2017
1U0H
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BU of 1u0h by Molmil
STRUCTURAL BASIS FOR THE INHIBITION OF MAMMALIAN ADENYLYL CYCLASE BY MANT-GTP
Descriptor: 3'-O-(N-METHYLANTHRANILOYL)-GUANOSINE-5'-TRIPHOSPHATE, 5'-GUANOSINE-DIPHOSPHATE-MONOTHIOPHOSPHATE, Adenylate cyclase, ...
Authors:Mou, T.C, Gille, A, Seifert, R.J, Sprang, S.R.
Deposit date:2004-07-13
Release date:2004-12-14
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Structural basis for the inhibition of mammalian membrane adenylyl cyclase by 2 '(3')-O-(N-Methylanthraniloyl)-guanosine 5 '-triphosphate.
J.Biol.Chem., 280, 2005
1TL7
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BU of 1tl7 by Molmil
Complex Of Gs- With The Catalytic Domains Of Mammalian Adenylyl Cyclase: Complex With 2'(3')-O-(N-methylanthraniloyl)-guanosine 5'-triphosphate and Mn
Descriptor: 3'-O-(N-METHYLANTHRANILOYL)-GUANOSINE-5'-TRIPHOSPHATE, 5'-GUANOSINE-DIPHOSPHATE-MONOTHIOPHOSPHATE, Adenylate cyclase, ...
Authors:Mou, T.C, Gille, A, Seifert, R.J, Sprang, S.R.
Deposit date:2004-06-09
Release date:2004-12-14
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structural basis for the inhibition of mammalian membrane adenylyl cyclase by 2 '(3')-O-(N-Methylanthraniloyl)-guanosine 5 '-triphosphate.
J.Biol.Chem., 280, 2005
6ODL
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BU of 6odl by Molmil
Crystal structure of GluN2A agonist binding domain with 4-butyl-(S)-CCG-IV
Descriptor: (1S,2R)-2-[(S)-amino(carboxy)methyl]-1-butylcyclopropane-1-carboxylic acid, Glutamate receptor ionotropic, NMDA 2A,Glutamate receptor ionotropic, ...
Authors:Mou, T.C, Clausen, R.P, Sprang, S.R, Hansen, K.B.
Deposit date:2019-03-26
Release date:2020-04-01
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Stereoselective synthesis of novel 2'-(S)-CCG-IV analogues as potent NMDA receptor agonists.
Eur.J.Med.Chem., 212, 2021
6TYL
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BU of 6tyl by Molmil
Crystal structure of mammalian Ric-8A:Galpha(i):nanobody complex
Descriptor: Guanine nucleotide-binding protein G(i) subunit alpha-1, Nanobody A, Nanobody B, ...
Authors:Mou, T.C, McClelland, L, Yates-Hansen, C, Sprang, S.R.
Deposit date:2019-08-09
Release date:2020-03-11
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (3.3 Å)
Cite:Structure of the G protein chaperone and guanine nucleotide exchange factor Ric-8A bound to G alpha i1.
Nat Commun, 11, 2020
6UKT
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BU of 6ukt by Molmil
Cryo-EM structure of mammalian Ric-8A:Galpha(i):nanobody complex
Descriptor: Guanine nucleotide-binding protein G(i) subunit alpha-1, NB8109, NB8117, ...
Authors:Mou, T.C, Zhang, K, Johnston, J.D, Chiu, W, Sprang, S.R.
Deposit date:2019-10-05
Release date:2020-03-11
Last modified:2024-11-06
Method:ELECTRON MICROSCOPY (3.87 Å)
Cite:Structure of the G protein chaperone and guanine nucleotide exchange factor Ric-8A bound to G alpha i1.
Nat Commun, 11, 2020
8U7X
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BU of 8u7x by Molmil
Crystal structure of non-receptor protein tyrosine phosphatase SHP2 in complex with inhibitor compound 24
Descriptor: (3S,4S)-8-{6-[(2-amino-3-chloropyridin-4-yl)sulfanyl]pyrido[2,3-b]pyrazin-2-yl}-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine, Tyrosine-protein phosphatase non-receptor type 11
Authors:Mou, T.C.
Deposit date:2023-09-15
Release date:2024-01-03
Method:X-RAY DIFFRACTION (2.06 Å)
Cite:Discovery of 5-Azaquinoxaline Derivatives as Potent and Orally Bioavailable Allosteric SHP2 Inhibitors.
Acs Med.Chem.Lett., 14, 2023
8U7W
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BU of 8u7w by Molmil
Crystal structure of non-receptor protein tyrosine phosphatase SHP2 in complex with inhibitor compound 7
Descriptor: 1-{6-[(2,3-dichlorophenyl)sulfanyl]pyrido[2,3-b]pyrazin-2-yl}-4-methylpiperidin-4-amine, Tyrosine-protein phosphatase non-receptor type 11
Authors:Mou, T.C.
Deposit date:2023-09-15
Release date:2024-01-03
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Discovery of 5-Azaquinoxaline Derivatives as Potent and Orally Bioavailable Allosteric SHP2 Inhibitors.
Acs Med.Chem.Lett., 14, 2023
6AU4
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BU of 6au4 by Molmil
Crystal structure of the major quadruplex formed in the human c-MYC promoter
Descriptor: DNA (5'-D(*TP*GP*AP*GP*GP*GP*TP*GP*GP*GP*TP*AP*GP*GP*GP*TP*GP*GP*GP*TP*AP*A)-3'), POTASSIUM ION
Authors:Stump, S, Mou, T.C, Sprang, S.R, Natale, N.R, Beall, H.D.
Deposit date:2017-08-30
Release date:2018-09-12
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Crystal structure of the major quadruplex formed in the promoter region of the human c-MYC oncogene.
PLoS ONE, 13, 2018
8U8X
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BU of 8u8x by Molmil
crystal structure of the receptor tyrosine kinase Human HER2 (ERBB2) YVMA mutant kinase domain in complex with inhibitor compound 27
Descriptor: 1-{(1R,3r,5S)-3-[(3M)-4-methyl-3-{3-methyl-4-[(1-methyl-1H-benzimidazol-5-yl)oxy]phenyl}-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-8-azabicyclo[3.2.1]octan-8-yl}propan-1-one, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Wang, J, Mou, T.C.
Deposit date:2023-09-18
Release date:2024-06-12
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1.69 Å)
Cite:Discovery of Potent and Selective Covalent Inhibitors of HER2 WT and HER2 YVMA .
J.Med.Chem., 67, 2024
6XAU
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BU of 6xau by Molmil
Structure of the PR domain from PRDM3
Descriptor: Histone-lysine N-methyltransferase MECOM
Authors:Loa, S, Mou, T.C, Sprang, S.R, Briknarova, K.
Deposit date:2020-06-04
Release date:2021-06-09
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (1.89 Å)
Cite:Structure of the PR domain from PRDM3
To Be Published
5DFT
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BU of 5dft by Molmil
Structure of the Eleventh Type III Domain from Human Fibronectin
Descriptor: CITRIC ACID, Fibronectin
Authors:Rusnac, D.-V, Mou, T.C, Sprang, S.R, Briknarova, K.
Deposit date:2015-08-27
Release date:2016-09-14
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structure of the Eleventh Type III Domain from Human Fibronectin
To Be Published
5T7H
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BU of 5t7h by Molmil
Crystal structure of dimeric yeast iso-1-cytochrome C with CYMAL6
Descriptor: 6-cyclohexylhexan-1-ol, Cytochrome c iso-1, HEME C, ...
Authors:Mcclelland, L, Mou, T.C, Sprang, S.R, Bowler, B.E.
Deposit date:2016-09-05
Release date:2017-03-22
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.003 Å)
Cite:Cytochrome c Can Form a Well-Defined Binding Pocket for Hydrocarbons.
J. Am. Chem. Soc., 138, 2016
6NMJ
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BU of 6nmj by Molmil
Crystal Structure of Rat Ric-8A G alpha binding domain, "Paratone-N Immersed"
Descriptor: Resistance to inhibitors of cholinesterase 8 homolog A (C. elegans)
Authors:Zeng, B, Mou, T.C, Sprang, S.R.
Deposit date:2019-01-11
Release date:2019-06-26
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structure, Function, and Dynamics of the G alpha Binding Domain of Ric-8A.
Structure, 27, 2019
6OVE
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BU of 6ove by Molmil
Crystal structure of GluN1/GluN2A NMDA receptor agonist binding domains with glycine and antagonist, 4-propylphenyl-ACEPC
Descriptor: (3R,5S)-5-[(2R)-2-amino-2-carboxyethyl]-1-(4-propylphenyl)pyrazolidine-3-carboxylic acid, GLYCINE, Glutamate receptor ionotropic, ...
Authors:Syrenne, J.T, Mou, T.C, Tamborini, L, Pinto, A, Sprang, S.R, Hansen, K.B.
Deposit date:2019-05-07
Release date:2020-05-13
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal structure of GluN1/GluN2A NMDA receptor agonist binding domains with glycine and antagonist, 3-ethylphenyl-ACEPC
To Be Published
6OVD
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BU of 6ovd by Molmil
Crystal structure of GluN1/GluN2A NMDA receptor agonist binding domains with glycine and antagonist, 3-ethylphenyl-ACEPC
Descriptor: (3S,5S)-5-[(2R)-2-amino-2-carboxyethyl]-1-(3-ethylphenyl)pyrazolidine-3-carboxylic acid, GLYCINE, Glutamate receptor ionotropic, ...
Authors:Syrenne, J.T, Mou, T.C, Tamborini, L, Pinto, A, Sprang, S.R, Hansen, K.B.
Deposit date:2019-05-07
Release date:2020-05-13
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.102 Å)
Cite:Crystal structure of GluN1/GluN2A NMDA receptor agonist binding domains with glycine and antagonist, 3-ethylphenyl-ACEPC
To Be Published
6MSV
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BU of 6msv by Molmil
Structure of the 6th type III domain from human fibronectin
Descriptor: Fibronectin, GLYCEROL
Authors:Loa, S, Mou, T.C, Sprang, S.R, Briknarova, K.
Deposit date:2018-10-18
Release date:2019-10-23
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structure of the 6th type III domain from human fibronectin
To Be Published

 

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數據於2024-11-13公開中

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