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8TAD
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BU of 8tad by Molmil
RTA in complex with inhibitor RUNT-206
分子名称: (9aM)-5,5-dimethyl-4,5-dihydronaphtho[1,2-b]thiophene-2-carboxylic acid, CHLORIDE ION, NONAETHYLENE GLYCOL, ...
著者Rudolph, M.J, Tumer, N.
登録日2023-06-27
公開日2024-05-01
実験手法X-RAY DIFFRACTION (2.76 Å)
主引用文献Structure-based design and optimization of a new class of small molecule inhibitors targeting the P-stalk binding pocket of ricin.
Bioorg.Med.Chem., 100, 2024
8T9V
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BU of 8t9v by Molmil
RTA-RUNT-59 complex structure
分子名称: (9aP)-7-fluoro-4,5-dihydronaphtho[1,2-b]thiophene-2-carboxylic acid, NONAETHYLENE GLYCOL, Ricin
著者Rudolph, M.J, Tumer, N.
登録日2023-06-26
公開日2024-05-01
実験手法X-RAY DIFFRACTION (1.945 Å)
主引用文献Structure-based design and optimization of a new class of small molecule inhibitors targeting the P-stalk binding pocket of ricin.
Bioorg.Med.Chem., 100, 2024
8TAB
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BU of 8tab by Molmil
RTA-PD00589
分子名称: 1,2-ETHANEDIOL, 4H,5H-naphtho[1,2-b]thiophene-2-carboxylic acid, CHLORIDE ION, ...
著者Rudolph, M.J, Tumer, N.
登録日2023-06-27
公開日2024-05-01
実験手法X-RAY DIFFRACTION (2.26 Å)
主引用文献Structure-based design and optimization of a new class of small molecule inhibitors targeting the P-stalk binding pocket of ricin.
Bioorg.Med.Chem., 100, 2024
3P3W
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BU of 3p3w by Molmil
Structure of a dimeric GluA3 N-terminal domain (NTD) at 4.2 A resolution
分子名称: Glutamate receptor 3
著者Rossmann, M, Sukumaran, M, Greger, I.H.
登録日2010-10-05
公開日2011-03-09
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (4.2 Å)
主引用文献Dynamics and allosteric potential of the AMPA receptor N-terminal domain
Embo J., 30, 2011
1UII
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BU of 1uii by Molmil
Crystal structure of Geminin coiled-coil domain
分子名称: Geminin
著者Yuan, P, Swaminathan, K, Robinson, H.
登録日2003-07-16
公開日2004-07-16
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献A dimerized coiled-coil domain and an adjoining part of geminin interact with two sites on Cdt1 for replication inhibition
Mol.Cell, 15, 2004
3O21
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BU of 3o21 by Molmil
High resolution structure of GluA3 N-terminal domain (NTD)
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Glutamate receptor 3, PHOSPHATE ION
著者Rossmann, M, Sukumaran, M, Penn, A.C, Veprintsev, D.B, Babu, M.M, Jensen, M.H, Greger, I.H.
登録日2010-07-22
公開日2011-03-09
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (2.201 Å)
主引用文献Dynamics and allosteric potential of the AMPA receptor N-terminal domain
Embo J., 30, 2011
4OL4
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BU of 4ol4 by Molmil
Crystal structure of secreted proline rich antigen MTC28 (Rv0040c) from Mycobacterium tuberculosis
分子名称: Proline-rich 28 kDa antigen
著者Kundu, P, Biswas, R, Mukherjee, S, Reinhard, L, Mueller-dieckmann, J, Weiss, M.S, Das, A.K.
登録日2014-01-23
公開日2015-01-28
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Structure-based Epitope Mapping of Mycobacterium tuberculosis Secretary Antigen MTC28
J.Biol.Chem., 291, 2016
4PWS
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BU of 4pws by Molmil
Crystal structure of secreted proline rich antigen MTC28 (Rv0040c) at 2.15 A with bound chloride from Mycobacterium tuberculosis
分子名称: CHLORIDE ION, Proline-rich 28 kDa antigen
著者Kundu, P, Biswas, R, Mukherjee, S, Reinhard, L, Mueller-dieckmann, J, Weiss, M.S, Das, A.K.
登録日2014-03-21
公開日2015-03-25
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Structure-based Epitope Mapping of Mycobacterium tuberculosis Secretary Antigen MTC28
J.Biol.Chem., 291, 2016
3IMX
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BU of 3imx by Molmil
Crystal Structure of human glucokinase in complex with a synthetic activator
分子名称: (2R)-3-cyclopentyl-N-(5-methoxy[1,3]thiazolo[5,4-b]pyridin-2-yl)-2-{4-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}propanamide, Glucokinase, SODIUM ION, ...
著者Stams, T, Vash, B.
登録日2009-08-11
公開日2009-10-06
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Investigation of functionally liver selective glucokinase activators for the treatment of type 2 diabetes.
J.Med.Chem., 52, 2009
4N8D
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BU of 4n8d by Molmil
DPP4 complexed with syn-7aa
分子名称: 1-(cis-1-phenyl-4-{[(2E)-3-phenylprop-2-en-1-yl]oxy}cyclohexyl)methanamine, 2-acetamido-2-deoxy-beta-D-glucopyranose, Dipeptidyl peptidase 4, ...
著者Ostermann, N, Zink, F, Kroemer, M.
登録日2013-10-17
公開日2014-02-12
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Discovery of C-(1-aryl-cyclohexyl)-methylamines as selective, orally available inhibitors of dipeptidyl peptidase IV.
Bioorg.Med.Chem.Lett., 24, 2014
4N8E
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BU of 4n8e by Molmil
DPP4 complexed with compound 12a
分子名称: 1-[cis-4-(aminomethyl)-4-(3-chlorophenyl)cyclohexyl]piperidin-2-one, 2-acetamido-2-deoxy-beta-D-glucopyranose, Dipeptidyl peptidase 4, ...
著者Ostermann, N, Zink, F, Kroemer, M.
登録日2013-10-17
公開日2014-02-12
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Discovery of C-(1-aryl-cyclohexyl)-methylamines as selective, orally available inhibitors of dipeptidyl peptidase IV.
Bioorg.Med.Chem.Lett., 24, 2014
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