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BARNASE T70C/S92C DISULFIDE MUTANT
分子名称:	BARNASE
著者	Clarke, J, Henrick, K, Fersht, A.R.
登録日	1995-03-31
公開日	1995-07-10
最終更新日	2011-07-13
実験手法	X-RAY DIFFRACTION (2 Å)
主引用文献	Disulfide mutants of barnase. I: Changes in stability and structure assessed by biophysical methods and X-ray crystallography. J.Mol.Biol., 253, 1995

1TYC

STRUCTURAL ANALYSIS OF A SERIES OF MUTANTS OF TYROSYL-TRNA SYNTHETASE: ENHANCEMENT OF CATALYSIS BY HYDROPHOBIC INTERACTIONS
分子名称:	TYROSYL-tRNA SYNTHETASE
著者	Brown, K.A, Brick, P, De Meester, P, Blow, D.M.
登録日	1992-07-06
公開日	1994-01-31
最終更新日	2024-02-14
実験手法	X-RAY DIFFRACTION (2.5 Å)
主引用文献	Structural Analysis of a Series of Mutants of Tyrosyl-tRNA Synthetase: Enhancement of Catalysis by Hydrophobic Interactions To be Published

1TYA

STRUCTURAL ANALYSIS OF A SERIES OF MUTANTS OF TYROSYL-TRNA SYNTHETASE: ENHANCEMENT OF CATALYSIS BY HYDROPHOBIC INTERACTIONS
分子名称:	TYROSINE, TYROSYL-tRNA SYNTHETASE
著者	Brown, K.A, De Meester, P, Blow, D.M.
登録日	1992-07-06
公開日	1994-01-31
最終更新日	2024-02-14
実験手法	X-RAY DIFFRACTION (2.8 Å)
主引用文献	Structural Analysis of a Series of Mutants of Tyrosyl-tRNA Synthetase: Enhancement of Catalysis by Hydrophobic Interactions To be Published

1TYB

STRUCTURAL ANALYSIS OF A SERIES OF MUTANTS OF TYROSYL-TRNA SYNTHETASE: ENHANCEMENT OF CATALYSIS BY HYDROPHOBIC INTERACTIONS
分子名称:	TYROSINE, TYROSYL-tRNA SYNTHETASE
著者	Brown, K.A, De Meester, P, Blow, D.M.
登録日	1992-07-06
公開日	1994-01-31
最終更新日	2024-02-14
実験手法	X-RAY DIFFRACTION (2.5 Å)
主引用文献	Structural Analysis of a Series of Mutants of Tyrosyl-tRNA Synthetase: Enhancement of Catalysis by Hydrophobic Interactions To be Published

1TYD

STRUCTURE OF TYROSYL-TRNA SYNTHETASE REFINED AT 2.3 ANGSTROMS RESOLUTION. INTERACTION OF THE ENZYME WITH THE TYROSYL ADENYLATE INTERMEDIATE
分子名称:	TYROSINE, TYROSYL-tRNA SYNTHETASE
著者	Brown, K.A, De Meester, P, Blow, D.M.
登録日	1992-07-06
公開日	1994-01-31
最終更新日	2024-02-14
実験手法	X-RAY DIFFRACTION (2.5 Å)
主引用文献	Structure of tyrosyl-tRNA synthetase refined at 2.3 A resolution. Interaction of the enzyme with the tyrosyl adenylate intermediate. J.Mol.Biol., 208, 1989

6SHZ

p53 cancer mutant Y220C
分子名称:	1,2-ETHANEDIOL, Cellular tumor antigen p53, GLYCEROL, ...
著者	Joerger, A.C, Structural Genomics Consortium (SGC)
登録日	2019-08-08
公開日	2020-02-19
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (1.24 Å)
主引用文献	Targeting Cavity-Creating p53 Cancer Mutations with Small-Molecule Stabilizers: the Y220X Paradigm. Acs Chem.Biol., 15, 2020

3ZME

Structure of the p53 core domain mutant Y220C bound to the small molecule PhiKan7242
分子名称:	2-(4-(4-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazol-1-yl)-N,N-dimethylethanamine, Cellular tumor antigen p53, ZINC ION
著者	Joerger, A.C, Wilcken, R.
登録日	2013-02-07
公開日	2013-05-08
最終更新日	2024-05-08
実験手法	X-RAY DIFFRACTION (1.35 Å)
主引用文献	Small molecule induced reactivation of mutant p53 in cancer cells. Nucleic Acids Res., 41, 2013

6GGD

p53 cancer mutant Y220C in complex with small-molecule stabilizer PK9324
分子名称:	Cellular tumor antigen p53, GLYCEROL, ZINC ION, ...
著者	Joerger, A.C, Bauer, M.R.
登録日	2018-05-03
公開日	2019-05-22
最終更新日	2024-01-17
実験手法	X-RAY DIFFRACTION (1.40000892 Å)
主引用文献	A structure-guided molecular chaperone approach for restoring the transcriptional activity of the p53 cancer mutant Y220C. Future Med Chem, 11, 2019

6GGB

p53 cancer mutant Y220C in complex with small-molecule stabilizer PK9318
分子名称:	1,2-ETHANEDIOL, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Cellular tumor antigen p53, ...
著者	Joerger, A.C, Bauer, M.R.
登録日	2018-05-03
公開日	2019-05-22
最終更新日	2024-01-17
実験手法	X-RAY DIFFRACTION (1.32 Å)
主引用文献	A structure-guided molecular chaperone approach for restoring the transcriptional activity of the p53 cancer mutant Y220C. Future Med Chem, 11, 2019

6GGA

p53 cancer mutant Y220C in complex with small-molecule stabilizer PK9284
分子名称:	(7-bromanyl-9-ethyl-carbazol-3-yl)methyl-methyl-azanium, Cellular tumor antigen p53, ZINC ION
著者	Joerger, A.C, Bauer, M.R.
登録日	2018-05-03
公開日	2019-05-22
最終更新日	2024-01-17
実験手法	X-RAY DIFFRACTION (1.55000126 Å)
主引用文献	A structure-guided molecular chaperone approach for restoring the transcriptional activity of the p53 cancer mutant Y220C. Future Med Chem, 11, 2019

6GGE

p53 cancer mutant Y220C in complex with small-molecule stabilizer PK9327
分子名称:	Cellular tumor antigen p53, ZINC ION, [9-ethyl-7-(5-methylthiophen-2-yl)carbazol-3-yl]methyl-methyl-azanium
著者	Joerger, A.C, Bauer, M.R.
登録日	2018-05-03
公開日	2019-05-22
最終更新日	2024-01-17
実験手法	X-RAY DIFFRACTION (1.25000513 Å)
主引用文献	A structure-guided molecular chaperone approach for restoring the transcriptional activity of the p53 cancer mutant Y220C. Future Med Chem, 11, 2019

6GGC

p53 cancer mutant Y220C in complex with small-molecule stabilizer PK9320
分子名称:	1,2-ETHANEDIOL, Cellular tumor antigen p53, GLYCEROL, ...
著者	Joerger, A.C.
登録日	2018-05-03
公開日	2019-05-22
最終更新日	2024-01-17
実験手法	X-RAY DIFFRACTION (1.24 Å)
主引用文献	A structure-guided molecular chaperone approach for restoring the transcriptional activity of the p53 cancer mutant Y220C. Future Med Chem, 11, 2019

6GGF

Structure of the p53 cancer mutant Y220C in complex with small-molecule stabilizer PK9328
分子名称:	Cellular tumor antigen p53, GLYCEROL, ZINC ION, ...
著者	Joerger, A.C, Bauer, M.R.
登録日	2018-05-03
公開日	2019-05-22
最終更新日	2024-01-17
実験手法	X-RAY DIFFRACTION (1.32000017 Å)
主引用文献	A structure-guided molecular chaperone approach for restoring the transcriptional activity of the p53 cancer mutant Y220C. Future Med Chem, 11, 2019

5G4N

Crystal structure of the p53 cancer mutant Y220C in complex with a difluorinated derivative of the small molecule stabilizer Phikan083
分子名称:	1-[9-(2,2-difluoroethyl)-9H-carbazol-3-yl]-N-methylmethanamine, CELLULAR TUMOR ANTIGEN P53, GLYCEROL, ...
著者	Joerger, A.C, Bauer, M, Jones, R.N, Spencer, J.
登録日	2016-05-13
公開日	2016-06-22
最終更新日	2024-01-10
実験手法	X-RAY DIFFRACTION (1.35 Å)
主引用文献	Harnessing Fluorine-Sulfur Contacts and Multipolar Interactions for the Design of P53 Mutant Y220C Rescue Drugs. Acs Chem.Biol., 11, 2016

5G4O

Crystal structure of the p53 cancer mutant Y220C in complex with a trifluorinated derivative of the small molecule stabilizer Phikan083
分子名称:	CELLULAR TUMOR ANTIGEN P53, N,N-dimethyl-1-[9-(2,2,2-trifluoroethyl)-9H-carbazol-3-yl]methanamine, ZINC ION
著者	Joerger, A.C, Bauer, M, Baud, M.G.J, Spencer, J.
登録日	2016-05-13
公開日	2016-06-22
最終更新日	2024-01-10
実験手法	X-RAY DIFFRACTION (1.48 Å)
主引用文献	Harnessing Fluorine-Sulfur Contacts and Multipolar Interactions for the Design of P53 Mutant Y220C Rescue Drugs. Acs Chem.Biol., 11, 2016

5G4M

Crystal structure of the p53 cancer mutant Y220C in complex with a monofluorinated derivative of the small molecule stabilizer Phikan083
分子名称:	1,2-ETHANEDIOL, 1-[9-(2-fluoroethyl)-9H-carbazol-3-yl]-N-methylmethanamine, CELLULAR TUMOR ANTIGEN P53, ...
著者	Joerger, A.C, Bauer, M.
登録日	2016-05-13
公開日	2016-06-22
最終更新日	2024-01-10
実験手法	X-RAY DIFFRACTION (1.38 Å)
主引用文献	Harnessing Fluorine-Sulfur Contacts and Multipolar Interactions for the Design of P53 Mutant Y220C Rescue Drugs. Acs Chem.Biol., 11, 2016

5A7B

Structure of the p53 cancer Y220C bound to the stabilizing small molecule PhiKan5211
分子名称:	2-[[4-(diethylamino)piperidin-1-yl]methyl]-6-ethynyl-4-(3-phenoxyprop-1-ynyl)phenol, CELLULAR TUMOR ANTIGEN P53, ZINC ION
著者	Joerger, A.C.
登録日	2015-07-03
公開日	2015-09-30
最終更新日	2024-01-10
実験手法	X-RAY DIFFRACTION (1.4 Å)
主引用文献	Experimental and Theoretical Evaluation of the Ethynyl Moiety as a Halogen Bioisostere. Acs Chem.Biol., 10, 2015

5AB9

Structure of the p53 cancer mutant Y220C with bound small molecule 7- ethyl-3-(piperidin-4-yl)-1H-indole
分子名称:	7-ethyl-3-(piperidin-4-yl)-1H-indole, CELLULAR TUMOR ANTIGEN P53, DI(HYDROXYETHYL)ETHER, ...
著者	Joerger, A.C.
登録日	2015-08-04
公開日	2015-12-16
最終更新日	2024-01-10
実験手法	X-RAY DIFFRACTION (1.36 Å)
主引用文献	Exploiting Transient Protein States for the Design of Small-Molecule Stabilizers of Mutant P53. Structure, 23, 2015

5ABA

Structure of the p53 cancer mutant Y220C with bound small-molecule stabilizer PhiKan5149
分子名称:	1-{1-[(3-bromo-5-chloro-2-hydroxyphenyl)methyl piperidin-4-yl}piperidin-4-ol], CELLULAR TUMOR ANTIGEN P53, ZINC ION
著者	Joerger, A.C.
登録日	2015-08-04
公開日	2015-12-16
最終更新日	2024-01-10
実験手法	X-RAY DIFFRACTION (1.62 Å)
主引用文献	Exploiting Transient Protein States for the Design of Small-Molecule Stabilizers of Mutant P53. Structure, 23, 2015

5AOI

Structure of the p53 cancer mutant Y220C in complex with an indole- based small molecule
分子名称:	2-(5-BROMO-7-ETHYL-2-METHYL-1H-INDOLE-3-YL)ETHAN-1-AMIN, CELLULAR TUMOR ANTIGEN P53, DI(HYDROXYETHYL)ETHER, ...
著者	Joerger, A.C, Wilcken, R.
登録日	2015-09-10
公開日	2015-12-16
最終更新日	2024-01-10
実験手法	X-RAY DIFFRACTION (1.78 Å)
主引用文献	Exploiting Transient Protein States for the Design of Small-Molecule Stabilizers of Mutant P53. Structure, 23, 2015

2P81

Engrailed homeodomain helix-turn-helix motif
分子名称:	Segmentation polarity homeobox protein engrailed
著者	Religa, T.L.
登録日	2007-03-21
公開日	2007-06-12
最終更新日	2024-05-22
実験手法	SOLUTION NMR
主引用文献	The helix-turn-helix motif as an ultrafast independently folding domain: The pathway of folding of Engrailed homeodomain. Proc.Natl.Acad.Sci.Usa, 104, 2007

6SI2

p53 cancer mutant Y220S
分子名称:	1,2-ETHANEDIOL, Cellular tumor antigen p53, GLYCEROL, ...
著者	Joerger, A.C, Bauer, M.R, Structural Genomics Consortium (SGC)
登録日	2019-08-08
公開日	2020-02-19
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (1.5 Å)
主引用文献	Targeting Cavity-Creating p53 Cancer Mutations with Small-Molecule Stabilizers: the Y220X Paradigm. Acs Chem.Biol., 15, 2020

6SI4

p53 cancer mutant Y220S in complex with small-molecule stabilizer PK9323
分子名称:	1-[9-ethyl-7-(1,3-thiazol-4-yl)carbazol-3-yl]-~{N}-methyl-methanamine, Cellular tumor antigen p53, GLYCEROL, ...
著者	Joerger, A.C, Kraemer, A, Knapp, S, Structural Genomics Consortium (SGC)
登録日	2019-08-08
公開日	2020-02-19
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (1.8 Å)
主引用文献	Targeting Cavity-Creating p53 Cancer Mutations with Small-Molecule Stabilizers: the Y220X Paradigm. Acs Chem.Biol., 15, 2020

6SI0

p53 cancer mutant Y220C in complex with small-molecule stabilizer PK9323
分子名称:	1,2-ETHANEDIOL, 1-[9-ethyl-7-(1,3-thiazol-4-yl)carbazol-3-yl]-~{N}-methyl-methanamine, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ...
著者	Joerger, A.C, Kraemer, A, Knapp, S, Structural Genomics Consortium (SGC)
登録日	2019-08-08
公開日	2020-02-19
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (1.53 Å)
主引用文献	Targeting Cavity-Creating p53 Cancer Mutations with Small-Molecule Stabilizers: the Y220X Paradigm. Acs Chem.Biol., 15, 2020

6SI3

p53 cancer mutant Y220S in complex with small-molecule stabilizer PK9301
分子名称:	1,2-ETHANEDIOL, 1-[7-bromanyl-9-[2,2,2-tris(fluoranyl)ethyl]carbazol-3-yl]-~{N}-methyl-methanamine, Cellular tumor antigen p53, ...
著者	Joerger, A.C, Bauer, M.R, Structural Genomics Consortium (SGC)
登録日	2019-08-08
公開日	2020-02-19
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (1.4 Å)
主引用文献	Targeting Cavity-Creating p53 Cancer Mutations with Small-Molecule Stabilizers: the Y220X Paradigm. Acs Chem.Biol., 15, 2020

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