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CRYSTAL STRUCTURE OF BOVINE BETA2-MICROGLOBULIN
分子名称:	BETA=2=-MICROGLOBULIN
著者	Becker, J.W, Reeke Junior, G.N.
登録日	1995-07-18
公開日	1995-10-15
最終更新日	2019-07-17
実験手法	X-RAY DIFFRACTION (2.5 Å)
主引用文献	Three-dimensional structure of beta 2-microglobulin. Proc.Natl.Acad.Sci.USA, 82, 1985

1FKD

FK-506 BINDING PROTEIN: THREE-DIMENSIONAL STRUCTURE OF THE COMPLEX WITH THE ANTAGONIST L-685,818
分子名称:	18-HYDROXYASCOMYCIN, FK506 BINDING PROTEIN
著者	Becker, J.W, Rotonda, J, Mckeever, B.M.
登録日	1992-12-02
公開日	1994-01-31
最終更新日	2024-02-07
実験手法	X-RAY DIFFRACTION (1.72 Å)
主引用文献	FK-506-binding protein: three-dimensional structure of the complex with the antagonist L-685,818. J.Biol.Chem., 268, 1993

1SLM

CRYSTAL STRUCTURE OF FIBROBLAST STROMELYSIN-1: THE C-TRUNCATED HUMAN PROENZYME
分子名称:	CALCIUM ION, STROMELYSIN-1, ZINC ION
著者	Becker, J.W.
登録日	1995-08-03
公開日	1996-12-17
最終更新日	2024-02-14
実験手法	X-RAY DIFFRACTION (1.9 Å)
主引用文献	Stromelysin-1: three-dimensional structure of the inhibited catalytic domain and of the C-truncated proenzyme. Protein Sci., 4, 1995

1SLN

CRYSTAL STRUCTURE OF THE CATALYTIC DOMAIN OF HUMAN FIBROBLAST STROMELYSIN-1 INHIBITED WITH THE N-CARBOXY-ALKYL INHIBITOR L-702,842
分子名称:	CALCIUM ION, N-(R-CARBOXY-ETHYL)-ALPHA-(S)-(2-PHENYLETHYL)GLYCYL-L-ARGININE-N-PHENYLAMIDE, STROMELYSIN-1, ...
著者	Becker, J.W.
登録日	1995-08-03
公開日	1996-12-17
最終更新日	2024-02-14
実験手法	X-RAY DIFFRACTION (2.27 Å)
主引用文献	Stromelysin-1: three-dimensional structure of the inhibited catalytic domain and of the C-truncated proenzyme. Protein Sci., 4, 1995

2FKE

FK-506-BINDING PROTEIN: THREE-DIMENSIONAL STRUCTURE OF THE COMPLEX WITH THE ANTAGONIST L-685,818
分子名称:	8-DEETHYL-8-[BUT-3-ENYL]-ASCOMYCIN, FK506 BINDING PROTEIN
著者	Becker, J.W, Mckeever, B.M, Rotonda, J.
登録日	1993-01-27
公開日	1994-01-31
最終更新日	2024-02-14
実験手法	X-RAY DIFFRACTION (1.72 Å)
主引用文献	FK-506-binding protein: three-dimensional structure of the complex with the antagonist L-685,818. J.Biol.Chem., 268, 1993

1QPF

FK506 BINDING PROTEIN (12 KDA, HUMAN) COMPLEX WITH L-709,858
分子名称:	C32-O-(1-ETHYL-INDOL-5-YL)ASCOMYCIN, PROTEIN (FK506-BINDING PROTEIN), heptyl beta-D-glucopyranoside
著者	Becker, J.W, Rotonda, J.
登録日	1999-05-24
公開日	1999-08-16
最終更新日	2023-08-16
実験手法	X-RAY DIFFRACTION (2.5 Å)
主引用文献	32-Indolyl ether derivatives of ascomycin: three-dimensional structures of complexes with FK506-binding protein. J.Med.Chem., 42, 1999

1QPL

FK506 BINDING PROTEIN (12 KDA, HUMAN) COMPLEX WITH L-707,587
分子名称:	C32-O-(1-METHYL-INDOL-5-YL) 18-HYDROXY-ASCOMYCIN, PROTEIN (FK506-BINDING PROTEIN)
著者	Becker, J.W, Rotonda, J.
登録日	1999-05-25
公開日	1999-08-16
最終更新日	2023-08-16
実験手法	X-RAY DIFFRACTION (2.9 Å)
主引用文献	32-Indolyl ether derivatives of ascomycin: three-dimensional structures of complexes with FK506-binding protein. J.Med.Chem., 42, 1999

1RE1

CRYSTAL STRUCTURE OF CASPASE-3 WITH A NICOTINIC ACID ALDEHYDE INHIBITOR
分子名称:	(3S)-3-{[(5-BROMOPYRIDIN-3-YL)CARBONYL]AMINO}-4-OXOBUTANOIC ACID, Caspase-3
著者	Becker, J.W, Rotonda, J, Soisson, S.M.
登録日	2003-11-06
公開日	2004-05-11
最終更新日	2023-09-20
実験手法	X-RAY DIFFRACTION (2.5 Å)
主引用文献	Reducing the Peptidyl Features of Caspase-3 Inhibitors: A Structural Analysis J.Med.Chem., 47, 2004

1RHM

CRYSTAL STRUCTURE OF THE COMPLEX OF CASPASE-3 WITH A NICOTINIC ACID ALDEHYDE INHIBITOR
分子名称:	4-[5-(2-CARBOXY-1-FORMYL-ETHYLCARBAMOYL)-PYRIDIN-3-YL]-BENZOIC ACID, CASP-3
著者	Becker, J.W, Rotonda, J, Soisson, S.M.
登録日	2003-11-14
公開日	2004-05-11
最終更新日	2023-09-20
実験手法	X-RAY DIFFRACTION (2.5 Å)
主引用文献	Reducing the Peptidyl Features of Caspase-3 Inhibitors: A Structural Analysis. J.Med.Chem., 47, 2004

1RHK

Crystal structure of the complex of caspase-3 with a phenyl-propyl-ketone inhibitor
分子名称:	Caspase-3, acetyl-asp-glu-val-fpr
著者	Becker, J.W, Rotonda, J, Soisson, S.M.
登録日	2003-11-14
公開日	2004-05-11
最終更新日	2023-09-20
実験手法	X-RAY DIFFRACTION (2.5 Å)
主引用文献	Reducing the Peptidyl Features of Caspase-3 Inhibitors: A Structural Analysis. J.Med.Chem., 47, 2004

1RHR

CRYSTAL STRUCTURE OF THE COMPLEX OF CASPASE-3 WITH A CINNAMIC ACID METHYL ESTER INHIBITOR
分子名称:	(3S)-5-[(2-CHLORO-6-FLUOROBENZYL)SULFANYL]-3-{[N-({2-ETHOXY-5-[(1E)-3-METHOXY-3-OXOPROP-1-ENYL]PHENYL}ACETYL)-D-VALYL]AMINO}-4-OXOPENTANOIC ACID, Caspase-3
著者	Becker, J.W, Rotonda, J, Soisson, S.M.
登録日	2003-11-14
公開日	2004-05-11
最終更新日	2023-09-20
実験手法	X-RAY DIFFRACTION (3 Å)
主引用文献	Reducing the Peptidyl Features of Caspase-3 Inhibitors: A Structural Analysis. J.Med.Chem., 47, 2004

1RHJ

CRYSTAL STRUCTURE OF THE COMPLEX OF CASPASE-3 WITH A PRYAZINONE INHIBITOR
分子名称:	3-(2-{5-TERT-BUTYL-3-[(4-METHYL-FURAZAN-3-YLMETHYL)-AMINO]-2-OXO-2H-PYRAZIN-1-YL}-BUTYRYLAMINO)-5-(HEXYL-METHYL-AMINO)-4-OXO-PENTANOIC ACID ANION, Caspase-3
著者	Becker, J.W, Rotonda, J, Soisson, S.M.
登録日	2003-11-14
公開日	2004-05-11
最終更新日	2023-09-20
実験手法	X-RAY DIFFRACTION (2.2 Å)
主引用文献	Reducing the Peptidyl Features of Caspase-3 Inhibitors: A Structural Analysis. J.Med.Chem., 47, 2004

1RHQ

CRYSTAL STRUCTURE OF THE COMPLEX OF CASPASE-3 WITH A BROMOMETHOXYPHENYL INHIBITOR
分子名称:	5-S-benzyl-3-({N-[(5-bromo-2-methoxyphenyl)acetyl]-L-valyl}amino)-2,3-dideoxy-5-thio-D-erythro-pentonic acid, Caspase-3
著者	Becker, J.W, Rotonda, J, Soisson, S.M.
登録日	2003-11-14
公開日	2004-05-11
最終更新日	2024-03-13
実験手法	X-RAY DIFFRACTION (3 Å)
主引用文献	Reducing the Peptidyl Features of Caspase-3 Inhibitors: A Structural Analysis. J.Med.Chem., 47, 2004

1RHU

CRYSTAL STRUCTURE OF THE COMPLEX OF CASPASE-3 WITH A 5,6,7 TRICYCLIC PEPTIDOMIMETIC INHIBITOR
分子名称:	(3S)-3-[({(2S)-5-[(N-ACETYL-L-ALPHA-ASPARTYL)AMINO]-4-OXO-1,2,4,5,6,7-HEXAHYDROAZEPINO[3,2,1-HI]INDOL-2-YL}CARBONYL)AMINO]-5-(BENZYLSULFANYL)-4-OXOPENTANOIC ACID, Caspase-3
著者	Becker, J.W, Rotonda, J, Soisson, S.M.
登録日	2003-11-14
公開日	2004-05-11
最終更新日	2023-09-20
実験手法	X-RAY DIFFRACTION (2.51 Å)
主引用文献	Reducing the Peptidyl Features of Caspase-3 Inhibitors: A Structural Analysis. J.Med.Chem., 47, 2004

1HFS

CRYSTAL STRUCTURE OF THE CATALYTIC DOMAIN OF HUMAN FIBROBLAST STROMELYSIN-1 INHIBITED WITH THE N-CARBOXY-ALKYL INHIBITOR L-764,004
分子名称:	6-(4'-FLUORO-BIPHENYL-4-YL)-4-(3-METHYL-1-PHENYLCARBAMOYL-BUTYLCARBAMOYL)-2-[4-(1-OXO-1,3-DIHYDRO-ISOINDOL-2-YL)-BUTYL]-HEXANOIC ACID, CALCIUM ION, STROMELYSIN-1, ...
著者	Becker, J.W.
登録日	1997-02-13
公開日	1998-02-18
最終更新日	2024-02-07
実験手法	X-RAY DIFFRACTION (1.7 Å)
主引用文献	Inhibition of stromelysin-1 (MMP-3) by P1'-biphenylylethyl carboxyalkyl dipeptides. J.Med.Chem., 40, 1997

1IBC

CRYSTAL STRUCTURE OF INHIBITED INTERLEUKIN-1BETA CONVERTING ENZYME
分子名称:	INTERLEUKIN-1BETA CONVERTING ENZYME, PEPTIDE ACE-TRP-GLU-HIS-ASA
著者	Becker, J.W, Rotonda, J.
登録日	1997-02-12
公開日	1998-02-11
最終更新日	2024-04-03
実験手法	X-RAY DIFFRACTION (2.73 Å)
主引用文献	A combinatorial approach for determining protease specificities: application to interleukin-1beta converting enzyme (ICE). Chem.Biol., 4, 1997

4Z9L

THE STRUCTURE OF JNK3 IN COMPLEX WITH AN IMIDAZOLE-PYRIMIDINE INHIBITOR
分子名称:	CYCLOHEXYL-{4-[5-(3,4-DICHLOROPHENYL)-2-PIPERIDIN-4-YL-3-PROPYL-3H-IMIDAZOL-4-YL]-PYRIMIDIN-2-YL}AMINE, Mitogen-activated protein kinase 10, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, ...
著者	Scapin, G, Patel, S.B, Lisnock, J, Becker, J.W, Lograsso, P.V, Smart, O.S, Bricogne, G.
登録日	2015-04-10
公開日	2015-05-06
最終更新日	2023-09-27
実験手法	X-RAY DIFFRACTION (2.1 Å)
主引用文献	The structure of JNK3 in complex with small molecule inhibitors: structural basis for potency and selectivity. Chem.Biol., 10, 2003

2B7Y

Fava Bean Lectin-Glucose Complex
分子名称:	2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, Favin alpha chain, ...
著者	Reeke Jr, G.N, Becker, J.W.
登録日	2005-10-05
公開日	2005-10-18
最終更新日	2024-04-03
実験手法	X-RAY DIFFRACTION (3 Å)
主引用文献	Three-dimensional structure of favin: saccharide binding-cyclic permutation in leguminous lectins Science, 234, 1986

2CNA

THE COVALENT AND THREE-DIMENSIONAL STRUCTURE OF CONCANAVALIN A, IV.ATOMIC COORDINATES,HYDROGEN BONDING,AND QUATERNARY STRUCTURE
分子名称:	CALCIUM ION, CONCANAVALIN A, MANGANESE (II) ION
著者	Reekejunior, G.N, Becker, J.W, Edelman, G.M.
登録日	1975-04-01
公開日	1977-03-16
最終更新日	2024-02-14
実験手法	X-RAY DIFFRACTION (2 Å)
主引用文献	The covalent and three-dimensional structure of concanavalin A. IV. Atomic coordinates, hydrogen bonding, and quaternary structure. J.Biol.Chem., 250, 1975

1YAT

IMPROVED CALCINEURIN INHIBITION BY YEAST FKBP12-DRUG COMPLEXES. CRYSTALLOGRAPHIC AND FUNCTIONAL ANALYSIS
分子名称:	8-DEETHYL-8-[BUT-3-ENYL]-ASCOMYCIN, FK506 BINDING PROTEIN
著者	Rotonda, J, Becker, J.W.
登録日	1993-01-06
公開日	1993-10-31
最終更新日	2024-02-14
実験手法	X-RAY DIFFRACTION (2.5 Å)
主引用文献	Improved calcineurin inhibition by yeast FKBP12-drug complexes. Crystallographic and functional analysis. J.Biol.Chem., 268, 1993

3BEJ

Structure of human FXR in complex with MFA-1 and co-activator peptide
分子名称:	(8alpha,10alpha,13alpha,17beta)-17-[(4-hydroxyphenyl)carbonyl]androsta-3,5-diene-3-carboxylic acid, Bile acid receptor, Nuclear receptor coactivator 1, ...
著者	Soisson, S.M, Parthasarathy, G, Becker, J.W.
登録日	2007-11-19
公開日	2008-03-18
最終更新日	2024-02-21
実験手法	X-RAY DIFFRACTION (1.9 Å)
主引用文献	Identification of a potent synthetic FXR agonist with an unexpected mode of binding and activation. Proc.Natl.Acad.Sci.Usa, 105, 2008

1IAU

HUMAN GRANZYME B IN COMPLEX WITH AC-IEPD-CHO
分子名称:	2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[beta-D-mannopyranose-(1-6)]alpha-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, GRANZYME B, ...
著者	Rotonda, J, Garcia-Calvo, M, Bull, H.G, Geissler, W.M, McKeever, B.M, Willoughby, C.A, Thornberry, N.A, Becker, J.W.
登録日	2001-03-23
公開日	2001-05-02
最終更新日	2023-11-15
実験手法	X-RAY DIFFRACTION (2 Å)
主引用文献	The three-dimensional structure of human granzyme B compared to caspase-3, key mediators of cell death with cleavage specificity for aspartic acid in P1. Chem.Biol., 8, 2001

1OUK

The structure of p38 alpha in complex with a pyridinylimidazole inhibitor
分子名称:	4-[5-[2-(1-PHENYL-ETHYLAMINO)-PYRIMIDIN-4-YL]-1-METHYL-4-(3-TRIFLUOROMETHYLPHENYL)-1H-IMIDAZOL-2-YL]-PIPERIDINE, Mitogen-activated protein kinase 14, SULFATE ION
著者	Fitzgerald, C.E, Patel, S.B, Becker, J.W, Cameron, P.M, Zaller, D, Pikounis, V.B, O'Keefe, S.J, Scapin, G.
登録日	2003-03-24
公開日	2003-09-02
最終更新日	2023-08-16
実験手法	X-RAY DIFFRACTION (2.5 Å)
主引用文献	Structural basis for p38alpha MAP kinase quinazolinone and pyridol-pyrimidine inhibitor specificity Nat.Struct.Biol., 10, 2003

2FJM

The structure of phosphotyrosine phosphatase 1B in complex with compound 2
分子名称:	(4-{(2S,4E)-2-(1H-1,2,3-BENZOTRIAZOL-1-YL)-2-[4-(METHOXYCARBONYL)PHENYL]-5-PHENYLPENT-4-ENYL}PHENYL)(DIFLUORO)METHYLPHOSPHONIC ACID, CHLORIDE ION, MAGNESIUM ION, ...
著者	Asante-Appiah, E, Patel, S, Desponts, C, Taylor, J.M, Lau, C, Dufresne, C, Therien, M, Friesen, R, Becker, J.W, Leblanc, Y, Scapin, G.
登録日	2006-01-03
公開日	2006-01-17
最終更新日	2023-08-30
実験手法	X-RAY DIFFRACTION (2.1 Å)
主引用文献	Conformation-assisted inhibition of protein-tyrosine phosphatase-1B elicits inhibitor selectivity over T-cell protein-tyrosine phosphatase. J.Biol.Chem., 281, 2006

2FJN

The structure of phosphotyrosine phosphatase 1B in complex with compound 2
分子名称:	(4-{(2S,4E)-2-(1H-1,2,3-BENZOTRIAZOL-1-YL)-2-[4-(METHOXYCARBONYL)PHENYL]-5-PHENYLPENT-4-ENYL}PHENYL)(DIFLUORO)METHYLPHOSPHONIC ACID, CHLORIDE ION, Tyrosine-protein phosphatase, ...
著者	Asante-Appiah, E, Patel, S, Desponts, C, Taylor, J.M, Lau, C, Dufresne, C, Therien, M, Friesen, R, Becker, J.W, Leblanc, Y, Kennedy, B.P, Scapin, G.
登録日	2006-01-03
公開日	2006-01-17
最終更新日	2023-08-30
実験手法	X-RAY DIFFRACTION (2.2 Å)
主引用文献	Conformation-assisted inhibition of protein-tyrosine phosphatase-1B elicits inhibitor selectivity over T-cell protein-tyrosine phosphatase. J.Biol.Chem., 281, 2006

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