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Periplasmic domain of RsgI2 of Clostridium thermocellum
分子名称:	Anti-sigma-I factor RsgI2, Periplasmic domain of RsgI2
著者	Chen, C, Dong, S, Feng, Y.G.
登録日	2022-11-04
公開日	2023-05-17
最終更新日	2024-04-03
実験手法	X-RAY DIFFRACTION (1.85 Å)
主引用文献	Essential autoproteolysis of bacterial anti-sigma factor RsgI for transmembrane signal transduction. Sci Adv, 9, 2023

8HEP

Solution structure of the periplasmic domain of the anti-sigma factor RsgI1 from Clostridium thermocellum
分子名称:	Anti-sigma factor
著者	Chen, C, Feng, Y.
登録日	2022-11-08
公開日	2023-05-24
最終更新日	2024-05-15
実験手法	SOLUTION NMR
主引用文献	Essential autoproteolysis of bacterial anti-sigma factor RsgI for transmembrane signal transduction. Sci Adv, 9, 2023

4M6P

Identification of Amides Derived From 1H-Pyrazolo[3,4-b]pyridine-5-carboxylic Acid as Potent Inhibitors of Human Nicotinamide Phosphoribosyltransferase (NAMPT)
分子名称:	N-[4-(phenylsulfonyl)benzyl]-2H-pyrazolo[3,4-b]pyridine-5-carboxamide, Nicotinamide phosphoribosyltransferase, PHOSPHATE ION
著者	Giannetti, A.M, Zheng, X, Skelton, N, Wang, W, Bravo, B, Feng, Y, Gunzner-Toste, J, Ho, Y, Hua, R, Wang, C, Zhao, Q, Liederer, B.M, Liu, Y, O'Brien, T, Oeh, J, Sampath, D, Shen, Y, Wang, L, Wu, H, Xiao, Y, Yuen, P, Zak, M, Zhao, G, Dragovich, P.S.
登録日	2013-08-10
公開日	2013-09-25
最終更新日	2024-02-28
実験手法	X-RAY DIFFRACTION (1.75 Å)
主引用文献	Identification of amides derived from 1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid as potent inhibitors of human nicotinamide phosphoribosyltransferase (NAMPT). Bioorg.Med.Chem.Lett., 23, 2013

4LV9

Fragment-based Identification of Amides Derived From trans-2-(Pyridin-3-yl)cyclopropanecarboxylic Acid as Potent Inhibitors of Human Nicotinamide Phosphoribosyltransferase (NAMPT)
分子名称:	1,2-ETHANEDIOL, 7-chloro-3-methyl-2H-1,2,4-benzothiadiazine 1,1-dioxide, Nicotinamide phosphoribosyltransferase, ...
著者	Giannetti, A.M, Zheng, X, Skelton, N, Wang, W, Bravo, B, Feng, Y, Gunzner-Toste, J, Ho, Y, Hua, R, Wang, C, Zhao, Q, Liederer, B.M, Liu, Y, O'Brien, T, Oeh, J, Sampath, D, Shen, Y, Wang, L, Wu, H, Xiao, Y, Yuen, P, Zak, M, Zhao, G, Dragovich, P.S.
登録日	2013-07-26
公開日	2013-09-25
最終更新日	2024-02-28
実験手法	X-RAY DIFFRACTION (1.807 Å)
主引用文献	Identification of amides derived from 1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid as potent inhibitors of human nicotinamide phosphoribosyltransferase (NAMPT). Bioorg.Med.Chem.Lett., 23, 2013

4LVF

Fragment-based Identification of Amides Derived From trans-2-(Pyridin-3-yl)cyclopropanecarboxylic Acid as Potent Inhibitors of Human Nicotinamide Phosphoribosyltransferase (NAMPT)
分子名称:	(1S,2S)-2-phenyl-N-(pyridin-4-yl)cyclopropanecarboxamide, 1,2-ETHANEDIOL, Nicotinamide phosphoribosyltransferase, ...
著者	Giannetti, A.M, Zheng, X, Skelton, N, Wang, W, Bravo, B, Feng, Y, Gunzner-Toste, J, Ho, Y, Hua, R, Wang, C, Zhao, Q, Liederer, B.M, Liu, Y, O'Brien, T, Oeh, J, Sampath, D, Shen, Y, Wang, L, Wu, H, Xiao, Y, Yuen, P, Zak, M, Zhao, G, Dragovich, P.S.
登録日	2013-07-26
公開日	2013-09-25
最終更新日	2024-02-28
実験手法	X-RAY DIFFRACTION (1.5 Å)
主引用文献	Identification of amides derived from 1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid as potent inhibitors of human nicotinamide phosphoribosyltransferase (NAMPT). Bioorg.Med.Chem.Lett., 23, 2013

1NMJ

The Solution Structure of Rat Ab-(1-28) and its Interaction with Zinc: Insights into the Scarity of Amyloid Deposition in Aged Rat Brain
分子名称:	amyloid beta-peptide from Alzheimer's disease amyloid A4 protein homolog
著者	Huang, J, Yao, Y, Tang, W.X.
登録日	2003-01-10
公開日	2003-01-28
最終更新日	2024-05-29
実験手法	SOLUTION NMR
主引用文献	The solution structure of rat Abeta-(1-28) and its interaction with zinc ion: insights into the scarcity of amyloid deposition in aged rat brain J.Biol.Inorg.Chem., 9, 2004

4LVA

Fragment-based Identification of Amides Derived From trans-2-(Pyridin-3-yl)cyclopropanecarboxylic Acid as Potent Inhibitors of Human Nicotinamide Phosphoribosyltransferase (NAMPT)
分子名称:	1,2-ETHANEDIOL, N-(4-{[4-(pyrrolidin-1-yl)piperidin-1-yl]sulfonyl}benzyl)-2H-pyrido[4,3-e][1,2,4]thiadiazin-3-amine 1,1-dioxide, Nicotinamide phosphoribosyltransferase, ...
著者	Giannetti, A.M, Zheng, X, Skelton, N, Wang, W, Bravo, B, Feng, Y, Gunzner-Toste, J, Ho, Y, Hua, R, Wang, C, Zhao, Q, Liederer, B.M, Liu, Y, O'Brien, T, Oeh, J, Sampath, D, Shen, Y, Wang, L, Wu, H, Xiao, Y, Yuen, P, Zak, M, Zhao, G, Dragovich, P.S.
登録日	2013-07-26
公開日	2013-09-25
最終更新日	2024-02-28
実験手法	X-RAY DIFFRACTION (1.55 Å)
主引用文献	Identification of amides derived from 1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid as potent inhibitors of human nicotinamide phosphoribosyltransferase (NAMPT). Bioorg.Med.Chem.Lett., 23, 2013

4LVD

Fragment-based Identification of Amides Derived From trans-2-(Pyridin-3-yl)cyclopropanecarboxylic Acid as Potent Inhibitors of Human Nicotinamide Phosphoribosyltransferase (NAMPT)
分子名称:	1,2-ETHANEDIOL, N-(4-nitrophenyl)cyclopropanecarboxamide, Nicotinamide phosphoribosyltransferase, ...
著者	Giannetti, A.M, Zheng, X, Skelton, N, Wang, W, Bravo, B, Feng, Y, Gunzner-Toste, J, Ho, Y, Hua, R, Wang, C, Zhao, Q, Liederer, B.M, Liu, Y, O'Brien, T, Oeh, J, Sampath, D, Shen, Y, Wang, L, Wu, H, Xiao, Y, Yuen, P, Zak, M, Zhao, G, Dragovich, P.S.
登録日	2013-07-26
公開日	2013-09-25
最終更新日	2024-02-28
実験手法	X-RAY DIFFRACTION (1.75 Å)
主引用文献	Identification of amides derived from 1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid as potent inhibitors of human nicotinamide phosphoribosyltransferase (NAMPT). Bioorg.Med.Chem.Lett., 23, 2013

3UIY

Crystal structure of SefD_dscA in H2O
分子名称:	Chimera protein of SefD and SefA
著者	Garnett, J.A, Wei-chao, L, Liu, B, Matthews, S.J.
登録日	2011-11-07
公開日	2012-05-02
最終更新日	2023-09-13
実験手法	X-RAY DIFFRACTION (3.1 Å)
主引用文献	Promoting crystallisation of the Salmonella enteritidis fimbriae 14 pilin SefD using deuterium oxide. Biochem.Biophys.Res.Commun., 421, 2012

7DIJ

Falcilysin in complex with MK-4815
分子名称:	1,2-ETHANEDIOL, 2-(aminomethyl)-3,5-ditert-butyl-phenol, ACETATE ION, ...
著者	Lin, J.Q, El Sahili, A, Lescar, J.
登録日	2020-11-19
公開日	2021-12-01
最終更新日	2024-05-29
実験手法	X-RAY DIFFRACTION (1.9 Å)
主引用文献	Identification of an inhibitory pocket in falcilysin provides a new avenue for malaria drug development. Cell Chem Biol, 31, 2024

7DI7

Falcilysin in complex with chloroquine
分子名称:	ACETATE ION, Falcilysin, N4-(7-CHLORO-QUINOLIN-4-YL)-N1,N1-DIETHYL-PENTANE-1,4-DIAMINE, ...
著者	Lin, J.Q, El Sahili, A, Lescar, J.
登録日	2020-11-18
公開日	2021-12-01
最終更新日	2024-05-29
実験手法	X-RAY DIFFRACTION (1.82 Å)
主引用文献	Identification of an inhibitory pocket in falcilysin provides a new avenue for malaria drug development. Cell Chem Biol, 31, 2024

7DIA

Falcilysin in complex with mefloquine
分子名称:	(S)-[2,8-bis(trifluoromethyl)quinolin-4-yl]-[(2S)-piperidin-2-yl]methanol, 1,2-ETHANEDIOL, ACETATE ION, ...
著者	Lin, J.Q, El Sahili, A, Lescar, J.
登録日	2020-11-18
公開日	2021-12-01
最終更新日	2024-05-29
実験手法	X-RAY DIFFRACTION (1.55 Å)
主引用文献	Identification of an inhibitory pocket in falcilysin provides a new avenue for malaria drug development. Cell Chem Biol, 31, 2024

6OC2

CSP1-cyc(Orn6D10)
分子名称:	Competence-stimulating peptide type 1
著者	Yang, Y.
登録日	2019-03-21
公開日	2020-01-08
最終更新日	2023-06-14
実験手法	SOLUTION NMR
主引用文献	Designing cyclic competence-stimulating peptide (CSP) analogs with pan-group quorum-sensing inhibition activity inStreptococcus pneumoniae. Proc.Natl.Acad.Sci.USA, 117, 2020

8SKN

Crystal structure of compound 3-bound human Dynamin-1-like protein GTPase-BSE fusion
分子名称:	1,2-ETHANEDIOL, Dynamin-1-like protein GTPase-BSE fusion, N-[4-(azetidin-1-yl)-2-(4-methylphenyl)quinolin-6-yl]-2-methylpropanamide
著者	Ma, B.
登録日	2023-04-20
公開日	2023-08-30
実験手法	X-RAY DIFFRACTION (2.41 Å)
主引用文献	Discovery of Potent Allosteric DRP1 Inhibitors by Disrupting Protein-Protein Interaction with MiD49. Acs Med.Chem.Lett., 14, 2023

6CFC

Crystal structure of soluble lytic transglycosylase Cj0843 of Campylobacter jejuni in complex with Bulgecin A
分子名称:	4-O-(4-O-SULFONYL-N-ACETYLGLUCOSAMININYL)-5-METHYLHYDROXY-L-PROLINE-TAURINE, Lytic transglycosylase, SULFATE ION
著者	van den Akker, F, Kumar, V.
登録日	2018-02-14
公開日	2018-05-30
最終更新日	2023-10-04
実験手法	X-RAY DIFFRACTION (2.04 Å)
主引用文献	Structural studies and molecular dynamics simulations suggest a processive mechanism of exolytic lytic transglycosylase from Campylobacter jejuni. PLoS ONE, 13, 2018

6OBW

CSP1-cyc(K6D10)
分子名称:	Competence-stimulating peptide type 1
著者	Yang, Y.
登録日	2019-03-21
公開日	2020-01-08
最終更新日	2023-06-14
実験手法	SOLUTION NMR
主引用文献	Designing cyclic competence-stimulating peptide (CSP) analogs with pan-group quorum-sensing inhibition activity inStreptococcus pneumoniae. Proc.Natl.Acad.Sci.USA, 117, 2020

6CF9

Crystal structure of soluble lytic transglycosylase Cj0843 of Campylobacter jejuni at 2.3A resolution in I23 space group
分子名称:	2-(2-METHOXYETHOXY)ETHANOL, ACETATE ION, Lytic transglycosylase
著者	van den Akker, F, Kumar, V.
登録日	2018-02-13
公開日	2018-05-30
最終更新日	2023-10-04
実験手法	X-RAY DIFFRACTION (2.29 Å)
主引用文献	Structural studies and molecular dynamics simulations suggest a processive mechanism of exolytic lytic transglycosylase from Campylobacter jejuni. PLoS ONE, 13, 2018

6OC4

CSP1-cyc(Dab6E10)
分子名称:	Competence-stimulating peptide type 1
著者	Yang, Y.
登録日	2019-03-21
公開日	2020-01-08
最終更新日	2020-02-05
実験手法	SOLUTION NMR
主引用文献	Designing cyclic competence-stimulating peptide (CSP) analogs with pan-group quorum-sensing inhibition activity inStreptococcus pneumoniae. Proc.Natl.Acad.Sci.USA, 117, 2020

8IQD

Crystal structure of AsfvPrimPol N-terminal Prim/Pol domain in complex with Mn2+ and dCTP
分子名称:	2'-DEOXYCYTIDINE-5'-TRIPHOSPHATE, MANGANESE (II) ION, Putative primase C962R
著者	Shao, Z.W, Gan, J.H.
登録日	2023-03-16
公開日	2023-07-26
最終更新日	2023-11-29
実験手法	X-RAY DIFFRACTION (2.39 Å)
主引用文献	Structures and implications of the C962R protein of African swine fever virus. Nucleic Acids Res., 51, 2023

8IQI

Structure of Full-Length AsfvPrimPol in Complex-Form
分子名称:	DNA (32-MER), MAGNESIUM ION, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, ...
著者	Shao, Z.W, Su, S.C, Gan, J.H.
登録日	2023-03-16
公開日	2023-07-26
最終更新日	2023-11-29
実験手法	ELECTRON MICROSCOPY (3.32 Å)
主引用文献	Structures and implications of the C962R protein of African swine fever virus. Nucleic Acids Res., 51, 2023

8IQB

Crystal structure of AsfvPrimPol N-terminal Prim/Pol domain
分子名称:	Putative primase C962R
著者	Shao, Z.W, Gan, J.H.
登録日	2023-03-16
公開日	2023-07-26
最終更新日	2023-11-29
実験手法	X-RAY DIFFRACTION (2.58 Å)
主引用文献	Structures and implications of the C962R protein of African swine fever virus. Nucleic Acids Res., 51, 2023

8IQC

Crystal structure of AsfvPrimPol N-terminal Prim/Pol domain in complex with Mn2+
分子名称:	MANGANESE (II) ION, Putative primase C962R
著者	Shao, Z.W, Gan, J.H.
登録日	2023-03-16
公開日	2023-07-26
最終更新日	2023-11-29
実験手法	X-RAY DIFFRACTION (2 Å)
主引用文献	Structures and implications of the C962R protein of African swine fever virus. Nucleic Acids Res., 51, 2023

8IQH

Structure of Full-Length AsfvPrimPol in Apo-Form
分子名称:	Putative primase C962R
著者	Shao, Z.W, Su, S.C, Gan, J.H.
登録日	2023-03-16
公開日	2023-07-26
最終更新日	2023-11-29
実験手法	ELECTRON MICROSCOPY (3.67 Å)
主引用文献	Structures and implications of the C962R protein of African swine fever virus. Nucleic Acids Res., 51, 2023

2MMP

Solution structure of a ribosomal protein
分子名称:	Uncharacterized protein
著者	Feng, Y.
登録日	2014-03-17
公開日	2014-06-11
最終更新日	2024-05-15
実験手法	SOLUTION NMR
主引用文献	Structure determination of archaea-specific ribosomal protein L46a reveals a novel protein fold. Biochem.Biophys.Res.Commun., 450, 2014

4L0L

Crystal structure of P.aeruginosa PBP3 in complex with compound 4
分子名称:	(6R,7S,10Z)-10-(2-amino-1,3-thiazol-4-yl)-1-(1,5-dihydroxy-4-oxo-1,4-dihydropyridin-2-yl)-7-formyl-13,13-dimethyl-3,9-dioxo-6-(sulfoamino)-12-oxa-2,4,8,11-tetraazatetradec-10-en-14-oic acid, Penicillin-binding protein 3
著者	Han, S, Marr, E.S.
登録日	2013-05-31
公開日	2013-08-21
最終更新日	2014-01-22
実験手法	X-RAY DIFFRACTION (2.1 Å)
主引用文献	Pyridone-conjugated monobactam antibiotics with gram-negative activity. J.Med.Chem., 56, 2013

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