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BU of 1agg by Molmil

THE SOLUTION STRUCTURE OF OMEGA-AGA-IVB, A P-TYPE CALCIUM CHANNEL ANTAGONIST FROM THE VENOM OF AGELENOPSIS APERTA
分子名称:	OMEGA-AGATOXIN-IVB
著者	Reily, M.D, Thanabal, V, Adams, M.E.
登録日	1995-11-03
公開日	1996-03-08
最終更新日	2014-02-05
実験手法	SOLUTION NMR
主引用文献	The solution structure of omega-Aga-IVB, a P-type calcium channel antagonist from venom of the funnel web spider, Agelenopsis aperta. J.Biomol.NMR, 5, 1995

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BU of 2pac by Molmil

SOLUTION STRUCTURE OF FE(II) CYTOCHROME C551 FROM PSEUDOMONAS AERUGINOSA AS DETERMINED BY TWO-DIMENSIONAL 1H NMR
分子名称:	CYTOCHROME C551, HEME C
著者	Detlefsen, D.J, Thanabal, V, Pecoraro, V.L, Wagner, G.
登録日	1993-05-05
公開日	1993-10-31
最終更新日	2021-03-10
実験手法	SOLUTION NMR
主引用文献	Solution structure of Fe(II) cytochrome c551 from Pseudomonas aeruginosa as determined by two-dimensional 1H NMR. Biochemistry, 30, 1991

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BU of 1ghu by Molmil

NMR solution structure of growth factor receptor-bound protein 2 (GRB2) SH2 domain, 24 structures
分子名称:	GRB2
著者	Thornton, K.H, Mueller, W.T, Mcconnell, P, Zhu, G, Saltiel, A.R, Thanabal, V.
登録日	1996-08-05
公開日	1997-01-27
最終更新日	2022-02-23
実験手法	SOLUTION NMR
主引用文献	Nuclear magnetic resonance solution structure of the growth factor receptor-bound protein 2 Src homology 2 domain. Biochemistry, 35, 1996

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BU of 1aw6 by Molmil

GAL4 (CD), NMR, 24 STRUCTURES
分子名称:	CADMIUM ION, GAL4 (CD)
著者	Baleja, J.D, Wagner, G.
登録日	1997-10-10
公開日	1998-04-15
最終更新日	2022-02-16
実験手法	SOLUTION NMR
主引用文献	Refined solution structure of the DNA-binding domain of GAL4 and use of 3J(113Cd,1H) in structure determination. J.Biomol.NMR, 10, 1997

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BU of 6mny by Molmil

Crystal structure of mouse BTK kinase domain in complex with compound 9a
分子名称:	5-amino-1-[(3R)-1-cyanopiperidin-3-yl]-3-[4-(2,4-difluorophenoxy)phenyl]-1H-pyrazole-4-carboxamide, Tyrosine-protein kinase
著者	Han, S, Caspers, N, Ohren, J.O.
登録日	2018-10-03
公開日	2019-01-30
実験手法	X-RAY DIFFRACTION (2.8 Å)
主引用文献	Aminopyrazole Carboxamide Bruton's Tyrosine Kinase Inhibitors. Irreversible to Reversible Covalent Reactive Group Tuning. ACS Med Chem Lett, 10, 2019

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BU of 1eit by Molmil

NMR STUDY OF MU-AGATOXIN
分子名称:	MU-AGATOXIN-I
著者	Omecinsky, D.O, Reily, M.D.
登録日	1995-12-14
公開日	1996-04-03
最終更新日	2022-02-16
実験手法	SOLUTION NMR
主引用文献	Three-dimensional structure analysis of mu-agatoxins: further evidence for common motifs among neurotoxins with diverse ion channel specificities. Biochemistry, 35, 1996

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BU of 2w6z by Molmil

Crystal structure of Biotin carboxylase from E. coli in complex with the 3-(3-Methyl-but-2-enyl)-3H-purin-6-ylamine fragment
分子名称:	3-(3-methylbut-2-en-1-yl)-3H-purin-6-amine, BIOTIN CARBOXYLASE, CHLORIDE ION
著者	Mochalkin, I, Miller, J.R.
登録日	2008-12-19
公開日	2009-05-19
最終更新日	2023-12-13
実験手法	X-RAY DIFFRACTION (1.9 Å)
主引用文献	Discovery of Antibacterial Biotin Carboxylase Inhibitors by Virtual Screening and Fragment-Based Approaches. Acs Chem.Biol., 4, 2009

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BU of 2w6m by Molmil

Crystal structure of Biotin carboxylase from E. coli in complex with amino-oxazole fragment series
分子名称:	(2-AMINO-1,3-OXAZOL-5-YL)-(3-BROMOPHENYL)METHANONE, BIOTIN CARBOXYLASE, CHLORIDE ION
著者	Mochalkin, I, Miller, J.R.
登録日	2008-12-18
公開日	2009-05-19
最終更新日	2023-12-13
実験手法	X-RAY DIFFRACTION (2 Å)
主引用文献	Discovery of Antibacterial Biotin Carboxylase Inhibitors by Virtual Screening and Fragment-Based Approaches. Acs Chem.Biol., 4, 2009

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BU of 2w6p by Molmil

Crystal structure of Biotin carboxylase from E. coli in complex with 5-Methyl-6-phenyl-quinazoline-2,4-diamine
分子名称:	5-methyl-6-phenylquinazoline-2,4-diamine, ACETYL-COA CARBOXYLASE
著者	Mochalkin, I, Miller, J.R.
登録日	2008-12-18
公開日	2009-05-19
最終更新日	2023-12-13
実験手法	X-RAY DIFFRACTION (1.85 Å)
主引用文献	Discovery of Antibacterial Biotin Carboxylase Inhibitors by Virtual Screening and Fragment-Based Approaches. Acs Chem.Biol., 4, 2009

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BU of 2w70 by Molmil

Crystal structure of Biotin carboxylase from E. coli in complex with the amino-thiazole-pyrimidine fragment
分子名称:	4-(2-amino-1,3-thiazol-4-yl)pyrimidin-2-amine, BIOTIN CARBOXYLASE, CHLORIDE ION
著者	Mochalkin, I, Miller, J.R.
登録日	2008-12-19
公開日	2009-05-19
最終更新日	2023-12-13
実験手法	X-RAY DIFFRACTION (1.77 Å)
主引用文献	Discovery of Antibacterial Biotin Carboxylase Inhibitors by Virtual Screening and Fragment-Based Approaches. Acs Chem.Biol., 4, 2009

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BU of 2w6n by Molmil

Crystal structure of Biotin carboxylase from E. coli in complex with amino-oxazole fragment series
分子名称:	2-AMINO-N,N-BIS(PHENYLMETHYL)-1,3-OXAZOLE-5-CARBOXAMIDE, BIOTIN CARBOXYLASE, CHLORIDE ION
著者	Mochalkin, I, Miller, J.R.
登録日	2008-12-18
公開日	2009-05-19
最終更新日	2023-12-13
実験手法	X-RAY DIFFRACTION (1.87 Å)
主引用文献	Discovery of Antibacterial Biotin Carboxylase Inhibitors by Virtual Screening and Fragment-Based Approaches. Acs Chem.Biol., 4, 2009

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BU of 2w6o by Molmil

Crystal structure of Biotin carboxylase from E. coli in complex with 4-Amino-7,7-dimethyl-7,8-dihydro-quinazolinone fragment
分子名称:	4-amino-7,7-dimethyl-7,8-dihydroquinazolin-5(6H)-one, BIOTIN CARBOXYLASE, CHLORIDE ION
著者	Mochalkin, I, Miller, J.R.
登録日	2008-12-18
公開日	2009-05-19
最終更新日	2023-12-13
実験手法	X-RAY DIFFRACTION (2.5 Å)
主引用文献	Discovery of Antibacterial Biotin Carboxylase Inhibitors by Virtual Screening and Fragment-Based Approaches. Acs Chem.Biol., 4, 2009

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BU of 2w6q by Molmil

Crystal structure of Biotin carboxylase from E. coli in complex with the triazine-2,4-diamine fragment
分子名称:	6-(2-phenoxyethoxy)-1,3,5-triazine-2,4-diamine, BIOTIN CARBOXYLASE, CHLORIDE ION
著者	Mochalkin, I, Miller, J.R.
登録日	2008-12-18
公開日	2009-05-19
最終更新日	2023-12-13
実験手法	X-RAY DIFFRACTION (2.05 Å)
主引用文献	Discovery of Antibacterial Biotin Carboxylase Inhibitors by Virtual Screening and Fragment-Based Approaches. Acs Chem.Biol., 4, 2009

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BU of 2w71 by Molmil

Crystal structure of Biotin carboxylase from E. coli in complex with the imidazole-pyrimidine inhibitor
分子名称:	4-[1-(2,6-dichlorobenzyl)-2-methyl-1H-imidazol-4-yl]pyrimidin-2-amine, BIOTIN CARBOXYLASE, CHLORIDE ION
著者	Mochalkin, I, Miller, J.R.
登録日	2008-12-19
公開日	2009-05-19
最終更新日	2023-12-13
実験手法	X-RAY DIFFRACTION (1.99 Å)
主引用文献	Discovery of Antibacterial Biotin Carboxylase Inhibitors by Virtual Screening and Fragment-Based Approaches. Acs Chem.Biol., 4, 2009

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BU of 1iva by Molmil

STRUCTURE-ACTIVITY RELATIONSHIPS FOR P-TYPE CALCIUM CHANNEL SELECTIVE OMEGA-AGATOXINS
分子名称:	OMEGA-AGATOXIN-IVA
著者	Reily, M.D, Holub, K.E.
登録日	1994-10-27
公開日	1995-02-07
最終更新日	2022-02-23
実験手法	SOLUTION NMR
主引用文献	Structure-activity relationships for P-type calcium channel-selective omega-agatoxins. Nat.Struct.Biol., 1, 1994

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