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Crystal structure of Rock2 with a pyridinylbenzamide based inhibitor
分子名称:	N-[(2,3-dihydro-1,4-benzodioxin-5-yl)methyl]-4-(pyridin-4-yl)benzamide, Rho-associated protein kinase 2
著者	Judge, R.A, Hobson, A.D.
登録日	2018-08-08
公開日	2018-11-14
最終更新日	2024-03-13
実験手法	X-RAY DIFFRACTION (2.86 Å)
主引用文献	Identification of Selective Dual ROCK1 and ROCK2 Inhibitors Using Structure Based Drug Design. J. Med. Chem., 61, 2018

7K09

Puromycin N-acetyltransferase in complex with acetyl-CoA
分子名称:	ACETYL COENZYME *A, Puromycin N-acetyltransferase
著者	Caputo, A.T, Newman, J, Adams, T.E, Peat, T.S.
登録日	2020-09-03
公開日	2021-03-17
最終更新日	2023-10-18
実験手法	X-RAY DIFFRACTION (2.313 Å)
主引用文献	Structure-guided selection of puromycin N-acetyltransferase mutants with enhanced selection stringency for deriving mammalian cell lines expressing recombinant proteins. Sci Rep, 11, 2021

7K0A

Puromycin N-acetyltransferase in complex with acetylated puromycin and CoA
分子名称:	1,2-ETHANEDIOL, COENZYME A, DI(HYDROXYETHYL)ETHER, ...
著者	Peat, T.S, Caputo, A.T, Newman, J, Adams, T.E.
登録日	2020-09-03
公開日	2021-03-17
最終更新日	2023-10-18
実験手法	X-RAY DIFFRACTION (2 Å)
主引用文献	Structure-guided selection of puromycin N-acetyltransferase mutants with enhanced selection stringency for deriving mammalian cell lines expressing recombinant proteins. Sci Rep, 11, 2021

6E9W

Crystal structure of Rock1 with a pyridinylbenzamide based inhibitor
分子名称:	N-[(2,3-dihydro-1,4-benzodioxin-5-yl)methyl]-4-(pyridin-4-yl)benzamide, Rho-associated protein kinase 1, SULFATE ION
著者	Judge, R.A, Hobson, A.D.
登録日	2018-08-01
公開日	2018-11-14
最終更新日	2024-03-13
実験手法	X-RAY DIFFRACTION (2.96 Å)
主引用文献	Identification of Selective Dual ROCK1 and ROCK2 Inhibitors Using Structure Based Drug Design. J. Med. Chem., 61, 2018

6E9L

Crystal structure of Protein Kinase A in complex with the PKI peptide and a pyridinylbenzamide based inhibitor
分子名称:	N-[(2,3-dihydro-1,4-benzodioxin-5-yl)methyl]-4-(pyridin-4-yl)benzamide, PKI peptide, cAMP-dependent protein kinase catalytic subunit alpha
著者	Judge, R.A, Hobson, A.D.
登録日	2018-08-01
公開日	2018-11-14
最終更新日	2019-01-16
実験手法	X-RAY DIFFRACTION (2.8 Å)
主引用文献	Identification of Selective Dual ROCK1 and ROCK2 Inhibitors Using Structure Based Drug Design. J. Med. Chem., 61, 2018

5FD6

zinc-bound manganese uptake regulator
分子名称:	Ferric uptake regulation protein, GLYCEROL, SULFATE ION, ...
著者	Bellini, D, Hemmings, A.M, Walsh, M.A.
登録日	2015-12-15
公開日	2016-12-28
最終更新日	2024-05-08
実験手法	X-RAY DIFFRACTION (2.48 Å)
主引用文献	structure of a zinc-bound manganese uptake regulator, mur To Be Published

4CNT

CRYSTAL STRUCTURE OF WT HUMAN CRMP-4
分子名称:	1,2-ETHANEDIOL, DIHYDROPYRIMIDINASE-LIKE 3, SODIUM ION
著者	Ponnusamy, R, Lohkamp, B.
登録日	2014-01-24
公開日	2014-06-18
最終更新日	2023-12-20
実験手法	X-RAY DIFFRACTION (2.65 Å)
主引用文献	Crystal Structure of Human Crmp-4: Correction of Intensities for Lattice-Translocation Disorder Acta Crystallogr.,Sect.D, 70, 2014

4CNS

Crystal structure of truncated human CRMP-4
分子名称:	1,2-ETHANEDIOL, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ...
著者	Ponnusamy, R, Lohkamp, B.
登録日	2014-01-24
公開日	2014-06-18
最終更新日	2023-12-20
実験手法	X-RAY DIFFRACTION (2.4 Å)
主引用文献	Crystal Structure of Human Crmp-4: Correction of Intensities for Lattice-Translocation Disorder Acta Crystallogr.,Sect.D, 70, 2014

6SNJ

Solution structure of the FUS/TLS RNA recognition motif in complex with U1 snRNA stem loop III
分子名称:	RNA-binding protein FUS, U1 snRNA stem loop III, RNA (28-MER)
著者	Campagne, S, Allain, F.H.
登録日	2019-08-26
公開日	2020-10-28
最終更新日	2024-06-19
実験手法	SOLUTION NMR
主引用文献	Aberrant interaction of FUS with the U1 snRNA provides a molecular mechanism of FUS induced amyotrophic lateral sclerosis. Nat Commun, 11, 2020

2GA2

h-MetAP2 complexed with A193400
分子名称:	5-BROMO-2-{[(4-CHLOROPHENYL)SULFONYL]AMINO}BENZOIC ACID, MANGANESE (II) ION, Methionine aminopeptidase 2
著者	Park, C.
登録日	2006-03-07
公開日	2007-03-13
最終更新日	2011-07-13
実験手法	X-RAY DIFFRACTION (1.95 Å)
主引用文献	Development of sulfonamide compounds as potent methionine aminopeptidase type II inhibitors with antiproliferative properties. Bioorg.Med.Chem.Lett., 16, 2006

3OHN

Crystal structure of the FimD translocation domain
分子名称:	Outer membrane usher protein FimD
著者	Wang, T, Li, H.
登録日	2010-08-17
公開日	2011-06-01
最終更新日	2023-09-06
実験手法	X-RAY DIFFRACTION (3.011 Å)
主引用文献	Crystal structure of the FimD usher bound to its cognate FimC-FimH substrate. Nature, 474, 2011

2M5Y

Solution Structure of the C-terminal domain of RV0431
分子名称:	Putative tuberculin related peptide
著者	Huang, C, Wang, T, Li, H.
登録日	2013-03-13
公開日	2014-02-26
最終更新日	2024-05-15
実験手法	SOLUTION NMR
主引用文献	Genetic regulation of vesiculogenesis and immunomodulation in Mycobacterium tuberculosis. Proc.Natl.Acad.Sci.USA, 110, 2013

5N0L

The structure of the cofactor binding GAF domain of the nutrient sensor CodY from Clostridium difficile
分子名称:	GTP-sensing transcriptional pleiotropic repressor CodY, ISOLEUCINE
著者	Levdikov, V.M, Blagova, E.V, Wilkinson, A.J, Sonenshein, A.L.
登録日	2017-02-03
公開日	2018-02-14
最終更新日	2024-01-17
実験手法	X-RAY DIFFRACTION (1.68 Å)
主引用文献	Impact of CodY protein on metabolism, sporulation and virulence in Clostridioides difficile ribotype 027. Plos One, 14, 2019

4GPH

Structure of HmuO, heme oxygenase from Corynebacterium diphtheriae, in complex with the putative reaction intermediates between Fe3+-biliverdin and biliverdin (data set IV)
分子名称:	ASCORBIC ACID, BILIVERDINE IX ALPHA, FE (III) ION, ...
著者	Unno, M, Ikeda-Saito, M.
登録日	2012-08-21
公開日	2013-08-21
最終更新日	2024-03-20
実験手法	X-RAY DIFFRACTION (1.7 Å)
主引用文献	Crystal Structures of the Substrate-Free and the Product-Bound forms of HmuO, a Heme Oxygenase from Corynebacterium diphtheriae To be Published

4GPC

Structure of the biliverdin-HmuO, heme oxygenase from Corynebacterium diphtheriae
分子名称:	ASCORBIC ACID, BILIVERDINE IX ALPHA, Heme oxygenase, ...
著者	Unno, M, Ikeda-Saito, M.
登録日	2012-08-20
公開日	2013-08-21
最終更新日	2024-03-20
実験手法	X-RAY DIFFRACTION (1.85 Å)
主引用文献	Crystal Structures of the Substrate-Free and the Product-Bound forms of HmuO, a Heme Oxygenase from Corynebacterium diphtheriae To be Published

5UPF

Crystal structure of human NAMPT with isoindoline urea inhibitor compound 53
分子名称:	5-fluoro-N-{4-[1-(2-hydroxy-2-methylpropanoyl)piperidin-4-yl]phenyl}-2H-isoindole-2-carboxamide, Nicotinamide phosphoribosyltransferase
著者	Longenecker, K.L, Raich, D, Korepanova, A.V.
登録日	2017-02-02
公開日	2017-06-28
最終更新日	2023-10-04
実験手法	X-RAY DIFFRACTION (1.69 Å)
主引用文献	SAR and characterization of non-substrate isoindoline urea inhibitors of nicotinamide phosphoribosyltransferase (NAMPT). Bioorg. Med. Chem. Lett., 27, 2017

4GOH

Structure of the substrate-free HmuO, HO from Corynebacterium diphtheriae
分子名称:	GLYCEROL, Heme oxygenase, SODIUM ION
著者	Unno, M, Ikeda-Saito, M.
登録日	2012-08-20
公開日	2013-08-21
最終更新日	2024-03-20
実験手法	X-RAY DIFFRACTION (1.8 Å)
主引用文献	Crystal Structure of the Substrate-Free and the Product-Bound forms of HmuO, a Heme Oxygenase from Corynebacterium diphtheriae To be Published

4GPF

Structure of the Fe3+-biliverdin-HmuO, heme oxygenase from Corynebacterium diphtheriae (data set III)
分子名称:	BILIVERDINE IX ALPHA, FE (III) ION, Heme oxygenase, ...
著者	Unno, M, Ikeda-Saito, M.
登録日	2012-08-20
公開日	2013-08-21
最終更新日	2024-03-20
実験手法	X-RAY DIFFRACTION (1.9 Å)
主引用文献	Crystal Structure of the Substrate-Free and the Product-Bound forms of HmuO, a Heme Oxygenase from Corynebacterium diphtheriae To be Published

5UPE

Crystal structure of human NAMPT with isoindoline urea inhibitor compound 5
分子名称:	N-{4-[(3-phenylpropyl)carbamoyl]phenyl}-2H-isoindole-2-carboxamide, Nicotinamide phosphoribosyltransferase
著者	Longenecker, K.L, Raich, D, Korepanova, A.V.
登録日	2017-02-02
公開日	2017-06-28
最終更新日	2023-10-04
実験手法	X-RAY DIFFRACTION (1.93 Å)
主引用文献	SAR and characterization of non-substrate isoindoline urea inhibitors of nicotinamide phosphoribosyltransferase (NAMPT). Bioorg. Med. Chem. Lett., 27, 2017

5VHB

Crystal structure of Protein Kinase A in complex with the PKI peptide and Aminobenzothiazole based inhibitor
分子名称:	N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-4-(pyridin-4-yl)benzamide, PKI peptide, cAMP-dependent protein kinase catalytic subunit alpha
著者	Judge, R.A.
登録日	2017-04-12
公開日	2018-01-31
最終更新日	2018-04-04
実験手法	X-RAY DIFFRACTION (1.61 Å)
主引用文献	Design of Aminobenzothiazole Inhibitors of Rho Kinases 1 and 2 by Using Protein Kinase A as a Structure Surrogate. Chembiochem, 19, 2018

5VIB

Crystal structure of Protein Kinase A in complex with the PKI peptide and Aminobenzothiazole based inhibitors
分子名称:	3-({[6-(pyridin-4-yl)-1,3-benzothiazol-2-yl][2-(pyrrolidin-1-yl)ethyl]amino}methyl)phenol, PKI peptide, cAMP-dependent protein kinase catalytic subunit alpha
著者	Judge, R.A.
登録日	2017-04-14
公開日	2018-01-31
最終更新日	2018-04-04
実験手法	X-RAY DIFFRACTION (2.37 Å)
主引用文献	Design of Aminobenzothiazole Inhibitors of Rho Kinases 1 and 2 by Using Protein Kinase A as a Structure Surrogate. Chembiochem, 19, 2018

5VI9

Crystal structure of Protein Kinase A in complex with the PKI peptide and Aminobenzothiazole based inhibitors
分子名称:	N-[(3-fluorophenyl)methyl]-6-(pyridin-4-yl)-1,3-benzothiazol-2-amine, PKI peptide, cAMP-dependent protein kinase catalytic subunit alpha
著者	Judge, R.A.
登録日	2017-04-14
公開日	2018-01-31
最終更新日	2018-04-04
実験手法	X-RAY DIFFRACTION (1.95 Å)
主引用文献	Design of Aminobenzothiazole Inhibitors of Rho Kinases 1 and 2 by Using Protein Kinase A as a Structure Surrogate. Chembiochem, 19, 2018

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