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6U5L
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BU of 6u5l by Molmil
Structure of human ULK4 in complex with an inhibitor
分子名称: DI(HYDROXYETHYL)ETHER, GLYCEROL, N~2~-(1H-benzimidazol-6-yl)-N~4~-(5-cyclobutyl-1H-pyrazol-3-yl)quinazoline-2,4-diamine, ...
著者Khamrui, S, Lazarus, M.B.
登録日2019-08-28
公開日2019-12-25
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献High-Resolution Structure and Inhibition of the Schizophrenia-Linked Pseudokinase ULK4.
J.Am.Chem.Soc., 142, 2020
4GGN
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BU of 4ggn by Molmil
Malaria invasion machinery protein complex
分子名称: Myosin A tail domain interacting protein MTIP, Myosin-A
著者Khamrui, S, Turley, S, Bergman, L.W, Hol, W.G.J.
登録日2012-08-06
公開日2013-07-03
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.29 Å)
主引用文献The structure of the D3 domain of Plasmodium falciparum myosin tail interacting protein MTIP in complex with a nanobody.
Mol.Biochem.Parasitol., 190, 2013
4GFT
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BU of 4gft by Molmil
Malaria invasion machinery protein-Nanobody complex
分子名称: 1,2-ETHANEDIOL, Myosin A tail domain interacting protein, Nanobody
著者Khamrui, S, Turley, S, Pardon, E, Steyaert, J, Verlinde, C, Fan, E, Bergman, L.W, Hol, W.G.J.
登録日2012-08-03
公開日2013-07-03
最終更新日2019-12-25
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献The structure of the D3 domain of Plasmodium falciparum myosin tail interacting protein MTIP in complex with a nanobody.
Mol.Biochem.Parasitol., 190, 2013
1XG6
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BU of 1xg6 by Molmil
The crystal structure of the P1 mutant (Leu to Arg)of a Winged bean chymotrypsin inhibitor(Kunitz)solved at 2.15A resolution
分子名称: Chymotrypsin inhibitor 3
著者Sen, U, Dattagupta, J.K, Dasgupta, J, Khamrui, S.
登録日2004-09-16
公開日2005-08-30
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Single mutation at P1 of a chymotrypsin inhibitor changes it to a trypsin inhibitor: X-ray structural (2.15 A) and biochemical basis
Biochim.Biophys.Acta, 1752, 2005
3I2X
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BU of 3i2x by Molmil
Crystal structure of a chimeric trypsin inhibitor having reactive site loop of ETI on the scaffold of WCI
分子名称: Chymotrypsin inhibitor 3
著者Sen, U, Khamrui, S, Dasgupta, J, Dattagupta, J.K, Majumder, S.
登録日2009-06-30
公開日2010-02-02
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.85 Å)
主引用文献Identification of a novel set of scaffolding residues that are instrumental for the inhibitory property of Kunitz (STI) inhibitors.
Protein Sci., 19, 2010
3I29
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BU of 3i29 by Molmil
Crystal structure of a binary complex between an mutant trypsin inhibitor with bovine trypsin
分子名称: CALCIUM ION, Cationic trypsin, Chymotrypsin inhibitor 3
著者Khamrui, S, Majumder, S, Dasgupta, J, Dattagupta, J.K, Sen, U.
登録日2009-06-29
公開日2010-06-16
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Role of remote scaffolding residues in the inhibitory loop pre-organization, flexibility, rigidification and enzyme inhibition of serine protease inhibitors
Biochim.Biophys.Acta, 1824, 2012
3I2A
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BU of 3i2a by Molmil
Crystal structure of a chimeric trypsin inhibitor protein STI(L)-WCI(S)
分子名称: CHLORIDE ION, Chymotrypsin inhibitor 3
著者Sen, U, Khamrui, S.
登録日2009-06-29
公開日2010-02-02
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Identification of a novel set of scaffolding residues that are instrumental for the inhibitory property of Kunitz (STI) inhibitors.
Protein Sci., 19, 2010
6U3J
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BU of 6u3j by Molmil
Structure of the 2-oxoadipate dehydrogenase DHTKD1
分子名称: 2-oxoglutarate dehydrogenase E1 component DHKTD1, mitochondrial, MAGNESIUM ION, ...
著者Khamrui, S, Lazarus, M.B.
登録日2019-08-21
公開日2020-07-22
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Inhibition and Crystal Structure of the Human DHTKD1-Thiamin Diphosphate Complex.
Acs Chem.Biol., 15, 2020
6UWY
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BU of 6uwy by Molmil
DYRK1A bound to a harmine derivative
分子名称: 4-(7-methoxy-1-methyl-9H-beta-carbolin-9-yl)butanamide, Dual specificity tyrosine-phosphorylation-regulated kinase 1A, TETRAETHYLENE GLYCOL
著者Khamrui, S, Lazarus, M.B.
登録日2019-11-05
公開日2020-02-12
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.95 Å)
主引用文献Synthesis and Biological Validation of a Harmine-Based, Central Nervous System (CNS)-Avoidant, Selective, Human beta-Cell Regenerative Dual-Specificity Tyrosine Phosphorylation-Regulated Kinase A (DYRK1A) Inhibitor.
J.Med.Chem., 63, 2020
8E8V
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BU of 8e8v by Molmil
Structure of the short LOR domain of human AASS bound to N-ethylsuccinimide
分子名称: 1-ETHYL-PYRROLIDINE-2,5-DIONE, Alpha-aminoadipic semialdehyde synthase, mitochondrial
著者Khamrui, S, Lazarus, M.B.
登録日2022-08-25
公開日2022-10-05
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.45 Å)
主引用文献Characterization and structure of the human lysine-2-oxoglutarate reductase domain, a novel therapeutic target for treatment of glutaric aciduria type 1.
Open Biology, 12, 2022
8E8T
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BU of 8e8t by Molmil
Structure of the short LOR domain of human AASS
分子名称: Alpha-aminoadipic semialdehyde synthase, mitochondrial
著者Khamrui, S, Lazarus, M.B.
登録日2022-08-25
公開日2022-10-05
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.18 Å)
主引用文献Characterization and structure of the human lysine-2-oxoglutarate reductase domain, a novel therapeutic target for treatment of glutaric aciduria type 1.
Open Biology, 12, 2022
8E8U
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BU of 8e8u by Molmil
Structure of the LOR domain of human AASS
分子名称: Alpha-aminoadipic semialdehyde synthase, mitochondrial, MAGNESIUM ION
著者Khamrui, S, Lazarus, M.B.
登録日2022-08-25
公開日2022-10-05
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.65 Å)
主引用文献Characterization and structure of the human lysine-2-oxoglutarate reductase domain, a novel therapeutic target for treatment of glutaric aciduria type 1.
Open Biology, 12, 2022
2QYI
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BU of 2qyi by Molmil
Crystal structure of a binary complex between an engineered trypsin inhibitor and Bovine trypsin
分子名称: CALCIUM ION, Cationic trypsin, Chymotrypsin inhibitor 3, ...
著者Khamrui, S, Dasgupta, J, Dattagupta, J.K, Sen, U.
登録日2007-08-15
公開日2008-08-19
最終更新日2021-11-10
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Crystal structure of a binary complex between an engineered trypsin inhibitor and Bovine trypsin
To be Published
2ESU
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BU of 2esu by Molmil
Crystal structure of Asn to Gln mutant of Winged Bean Chymotrypsin Inhibitor protein
分子名称: Chymotrypsin inhibitor 3, NICKEL (II) ION, SULFATE ION
著者Dattagupta, J.K, Sen, U, Dasgupta, J, Khamrui, S.
登録日2005-10-27
公開日2006-06-13
最終更新日2021-10-20
実験手法X-RAY DIFFRACTION (1.94 Å)
主引用文献Spacer Asn Determines the Fate of Kunitz (STI) Inhibitors, as Revealed by Structural and Biochemical Studies on WCI Mutants.
Biochemistry, 45, 2006
3QYD
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BU of 3qyd by Molmil
Crystal structure of a recombinant chimeric trypsin inhibitor
分子名称: Chymotrypsin inhibitor 3
著者Sen, U, Majumder, S, Khamrui, S, Dasgupta, J.
登録日2011-03-03
公開日2011-05-25
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.97 Å)
主引用文献Role of remote scaffolding residues in the inhibitory loop pre-organization, flexibility, rigidification and enzyme inhibition of serine protease inhibitors
Biochim.Biophys.Acta, 1824, 2012
2BEB
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BU of 2beb by Molmil
X-ray structure of Asn to Thr mutant of Winged Bean Chymotrypsin inhibitor
分子名称: Chymotrypsin inhibitor 3
著者Dattagupta, J.K, Sen, U, Dasgupta, J, Khamrui, S.
登録日2005-10-24
公開日2006-06-13
最終更新日2021-10-20
実験手法X-RAY DIFFRACTION (2.81 Å)
主引用文献Spacer Asn Determines the Fate of Kunitz (STI) Inhibitors, as Revealed by Structural and Biochemical Studies on WCI Mutants.
Biochemistry, 45, 2006
2BEA
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BU of 2bea by Molmil
Crystal structure of Asn14 to Gly mutant of WCI
分子名称: Chymotrypsin inhibitor 3
著者Dattagupta, J.K, Sen, U, Dasgupta, J, Khamrui, S.
登録日2005-10-24
公開日2006-06-13
最終更新日2021-10-20
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Spacer Asn Determines the Fate of Kunitz (STI) Inhibitors, as Revealed by Structural and Biochemical Studies on WCI Mutants.
Biochemistry, 45, 2006
2ET2
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BU of 2et2 by Molmil
Crystal structure of an Asn to Ala mutant of Winged Bean Chymotrypsin Inhibitor protein
分子名称: Chymotrypsin inhibitor 3, NICKEL (II) ION, SULFATE ION
著者Dattagupta, J.K, Sen, U, Dasgupta, J, Khamrui, S.
登録日2005-10-27
公開日2006-06-13
最終更新日2021-10-20
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Spacer Asn Determines the Fate of Kunitz (STI) Inhibitors, as Revealed by Structural and Biochemical Studies on WCI Mutants.
Biochemistry, 45, 2006
3RX6
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BU of 3rx6 by Molmil
Crystal structure of Polarity Suppression protein from Enterobacteria phage P4
分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, IODIDE ION, MERCURY (II) ION, ...
著者Banerjee, R, Nath, S, Khamrui, S, Sen, R, Sen, U.
登録日2011-05-10
公開日2012-07-25
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (2.039 Å)
主引用文献The first structure of polarity suppression protein, Psu from enterobacteria phage P4, reveals a novel fold and a knotted dimer
J.Biol.Chem., 287, 2012
3VEQ
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BU of 3veq by Molmil
A binary complex betwwen bovine pancreatic trypsin and a engineered mutant trypsin inhibitor
分子名称: CALCIUM ION, Cationic trypsin, Chymotrypsin inhibitor 3
著者Sen, U, Majumder, S, Khamrui, S, Dasgupta, J.
登録日2012-01-09
公開日2012-10-03
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Role of remote scaffolding residues in the inhibitory loop pre-organization, flexibility, rigidification and enzyme inhibition of serine protease inhibitors
Biochim.Biophys.Acta, 1824, 2012
4TLP
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BU of 4tlp by Molmil
Crystal structure of a alanine91 mutant of WCI
分子名称: Chymotrypsin inhibitor 3
著者Sen, U, Majumder, S.
登録日2014-05-30
公開日2014-07-02
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献A conserved tryptophan (W91) at the barrel-lid junction modulates the packing and stability of Kunitz (STI) family of inhibitors.
Biochim.Biophys.Acta, 1854, 2015
4DVD
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BU of 4dvd by Molmil
Crystal structure of the disulphide linked knotted homodimer of Psu
分子名称: Polarity suppression protein
著者Banerjee, R, Nath, S, Sen, U.
登録日2012-02-23
公開日2012-11-21
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献The first structure of polarity suppression protein, Psu from enterobacteria phage P4, reveals a novel fold and a knotted dimer
J.Biol.Chem., 287, 2012
4LX8
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Crystal structure (2.2A) of Mg2+ bound CheY3 of Vibrio cholerae
分子名称: Chemotaxis protein CheY, MAGNESIUM ION
著者Dasgupta, J, Biswas, M.
登録日2013-07-29
公開日2013-10-09
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Conformational Barrier of CheY3 and Inability of CheY4 to Bind FliM Control the Flagellar Motor Action in Vibrio cholerae
Plos One, 8, 2013
3TO5
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BU of 3to5 by Molmil
High resolution structure of CheY3 from Vibrio cholerae
分子名称: CALCIUM ION, CheY homolog
著者Dasgupta, J, Sen, U, Biswas, M.
登録日2011-09-04
公開日2012-09-12
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Conformational Barrier of CheY3 and Inability of CheY4 to Bind FliM Control the Flagellar Motor Action in Vibrio cholerae
Plos One, 8, 2013
4H60
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BU of 4h60 by Molmil
High resolution structure of Vibrio cholerae chemotaxis protein CheY4 crystallized in low pH (4.0) condition
分子名称: CALCIUM ION, Chemotaxis protein CheY, SULFATE ION
著者Biswas, M, Dasgupta, J, Sen, U.
登録日2012-09-19
公開日2013-08-07
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.66 Å)
主引用文献Conformational Barrier of CheY3 and Inability of CheY4 to Bind FliM Control the Flagellar Motor Action in Vibrio cholerae.
Plos One, 8, 2013

 

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