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3Q40
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Sulphur SAD structure solution of proteinase K grown in SO4-less solution.
分子名称: CALCIUM ION, NITRATE ION, Proteinase K
著者Jakoncic, J.
登録日2010-12-22
公開日2011-06-22
最終更新日2017-11-08
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystallization of Macromolecules in Selenate to Solve the Phase Problem
To be Published
4EZO
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BU of 4ezo by Molmil
Crystal structure of the substrate binding domain of E.coli DnaK in complex with PR-39 (residues 1 to 15)
分子名称: Antibacterial protein PR-39, Chaperone protein DnaK, SULFATE ION
著者Zahn, M, Straeter, N.
登録日2012-05-03
公開日2013-04-17
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structural Studies on the Forward and Reverse Binding Modes of Peptides to the Chaperone DnaK.
J.Mol.Biol., 425, 2013
3PH5
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BU of 3ph5 by Molmil
Bovine beta lactoglobulin crystallized through ligandation of yttrium cations
分子名称: Beta-lactoglobulin, CHLORIDE ION, YTTRIUM (III) ION
著者Zocher, G, Stehle, T.
登録日2010-11-03
公開日2011-09-21
最終更新日2014-02-19
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Novel Approach to Protein Crystallization through Ligandation of Yttrium Cations
J.Appl.Crystallogr., 44, 2011
4EZZ
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BU of 4ezz by Molmil
Crystal structure of the substrate binding domain of E.coli DnaK in complex with the designer peptide ELPLVKI
分子名称: Chaperone protein DnaK, synthetic peptide ELPLVKI
著者Zahn, M, Straeter, N.
登録日2012-05-03
公開日2013-04-17
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Structural Studies on the Forward and Reverse Binding Modes of Peptides to the Chaperone DnaK.
J.Mol.Biol., 425, 2013
7F3G
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BU of 7f3g by Molmil
Crystal structure of DCLK1 kinase domain in complex with ruxolitinib
分子名称: (3R)-3-cyclopentyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]propanenitrile, Isoform 4 of Serine/threonine-protein kinase DCLK1
著者Lim, H.J, Jang, D.M, Kim, H.S.
登録日2021-06-16
公開日2021-08-18
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structural Basis of Inhibition of DCLK1 by Ruxolitinib.
Int J Mol Sci, 22, 2021
3PI0
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BU of 3pi0 by Molmil
Endothiapepsin in complex with a fragment
分子名称: DIMETHYL SULFOXIDE, Endothiapepsin, GLYCEROL, ...
著者Koester, H, Heine, A, Klebe, G.
登録日2010-11-05
公開日2011-11-02
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.64 Å)
主引用文献A small nonrule of 3 compatible fragment library provides high hit rate of endothiapepsin crystal structures with various fragment chemotypes.
J.Med.Chem., 54, 2011
3PH6
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BU of 3ph6 by Molmil
Bovine beta lactoglobulin crytsallized through ligandation of yttrium
分子名称: Beta-lactoglobulin, CHLORIDE ION, YTTRIUM (III) ION
著者Zocher, G, Stehle, T.
登録日2010-11-03
公開日2011-09-21
最終更新日2020-01-15
実験手法X-RAY DIFFRACTION (2.53 Å)
主引用文献Novel Approach to Protein Crystallization through Ligandation of Yttrium Cations
J.Appl.Crystallogr., 44, 2011
3PI9
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BU of 3pi9 by Molmil
Site-specific Glycosylation of Hemoglobin Utilizing Oxime Ligation Chemistry as a Viable Alternative to PEGylation
分子名称: CARBON MONOXIDE, Hemoglobin subunit alpha, Hemoglobin subunit beta, ...
著者Bhatt, V.S, Styslinger, T.J, Zhang, N, Wang, P.G, Palmer, A.F.
登録日2010-11-05
公開日2010-11-24
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献

3PWM
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BU of 3pwm by Molmil
HIV-1 Protease Mutant L76V with Darunavir
分子名称: (3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE, ACETATE ION, CHLORIDE ION, ...
著者Zhang, Y, Weber, I.T.
登録日2010-12-08
公開日2011-04-20
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.46 Å)
主引用文献The L76V Drug Resistance Mutation Decreases the Dimer Stability and Rate of Autoprocessing of HIV-1 Protease by Reducing Internal Hydrophobic Contacts.
Biochemistry, 50, 2011
4F1D
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BU of 4f1d by Molmil
Human Insulin
分子名称: CHLORIDE ION, Insulin A chain, Insulin B chain, ...
著者Favero-Retto, M.P, Palmieri, L.C, Lima, L.M.T.R.
登録日2012-05-06
公開日2013-05-08
最終更新日2013-12-18
実験手法X-RAY DIFFRACTION (1.637 Å)
主引用文献Structural meta-analysis of regular human insulin in pharmaceutical formulations.
Eur J Pharm Biopharm, 85, 2013
4F26
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Crystal structure of the second RRM domain of human PABPC1 a pH 9.0
分子名称: Polyadenylate-binding protein 1
著者Kozlov, G, Safaee, N, Gehring, K.
登録日2012-05-07
公開日2012-08-08
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Interdomain Allostery Promotes Assembly of the Poly(A) mRNA Complex with PABP and eIF4G.
Mol.Cell, 48, 2012
3PYH
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Bovine trypsin variant X(tripleGlu217Ile227) in complex with small molecule inhibitor
分子名称: 3-(3-carbamimidoylphenyl)-N-(2'-sulfamoylbiphenyl-4-yl)-1,2-oxazole-4-carboxamide, CALCIUM ION, CHLORIDE ION, ...
著者Tziridis, A, Neumann, P, Kolenko, P, Stubbs, M.T.
登録日2010-12-13
公開日2011-12-21
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Correlating structure and ligand affinity in drug discovery: a cautionary tale involving second shell residues.
Biol.Chem., 395, 2014
7EYI
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BU of 7eyi by Molmil
Crystal structure of ZBTB7A in complex with gamma-globin -200 sequence element with C-194A mutation
分子名称: BORIC ACID, DNA (5'-D(*AP*TP*AP*GP*GP*GP*CP*CP*CP*CP*TP*TP*CP*CP*CP*AP*AP*C)-3'), DNA (5'-D(*TP*GP*TP*TP*GP*GP*GP*AP*AP*GP*GP*GP*GP*CP*CP*CP*TP*A)-3'), ...
著者Yang, Y, Shi, Y.Y.
登録日2021-05-31
公開日2021-09-01
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (2.401 Å)
主引用文献Structural basis for human ZBTB7A action at the fetal globin promoter.
Cell Rep, 36, 2021
3PRK
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BU of 3prk by Molmil
INHIBITION OF PROTEINASE K BY METHOXYSUCCINYL-ALA-ALA-PRO-ALA-CHLOROMETHYL KETONE. AN X-RAY STUDY AT 2.2-ANGSTROMS RESOLUTION
分子名称: CALCIUM ION, METHOXYSUCCINYL-ALA-ALA-PRO-ALA-CHLOROMETHYL KETONE, PROTEINASE K
著者Wolf, W.M, Bajorath, J, Mueller, A, Raghunathan, S, Singh, T.P, Hinrichs, W, Saenger, W.
登録日1991-08-07
公開日1994-01-31
最終更新日2017-11-29
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Inhibition of proteinase K by methoxysuccinyl-Ala-Ala-Pro-Ala-chloromethyl ketone. An x-ray study at 2.2-A resolution.
J.Biol.Chem., 266, 1991
4F8A
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BU of 4f8a by Molmil
Cyclic nucleotide binding-homology domain from mouse EAG1 potassium channel
分子名称: Potassium voltage-gated channel subfamily H member 1
著者Marques-Carvalho, M.J, Sahoo, N, Muskett, F.W, Vieira-Pires, R.S, Gabant, G, Cadene, M, Schonherr, R, Morais-Cabral, J.H.
登録日2012-05-17
公開日2012-07-11
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structural, Biochemical, and Functional Characterization of the Cyclic Nucleotide Binding Homology Domain from the Mouse EAG1 Potassium Channel.
J.Mol.Biol., 423, 2012
4F6D
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BU of 4f6d by Molmil
Oxy structure of His100Phe Cerebratulus lacteus mini-hemoglobin
分子名称: Neural hemoglobin, OXYGEN MOLECULE, PROTOPORPHYRIN IX CONTAINING FE
著者Soman, J, Salter, M.D, Olson, J.S.
登録日2012-05-14
公開日2012-05-30
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Oxy structure of His100Phe Cerebratulus lacteus mini-hemoglobin
To be Published
4F6I
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Oxy Structure of His100Trp Cerebratulus lacteus mini-hemoglobin
分子名称: Neural hemoglobin, OXYGEN MOLECULE, PROTOPORPHYRIN IX CONTAINING FE
著者Soman, J, Salter, M.D, Olson, J.S.
登録日2012-05-14
公開日2012-05-30
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.56 Å)
主引用文献Oxy Structure of His100Trp Cerebratulus lacteus mini-hemoglobin
To be Published
7F26
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BU of 7f26 by Molmil
Crystal structure of lysozyme
分子名称: Lysozyme C
著者Liang, M.
登録日2021-06-10
公開日2021-09-15
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Novel combined crystallization plate for high-throughput crystal screening and in situ data collection at a crystallography beamline.
Acta Crystallogr.,Sect.F, 77, 2021
3Q02
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BU of 3q02 by Molmil
Crystal structure of plasminogen activator inhibitor-1 in a metastable active conformation.
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Plasminogen activator inhibitor 1, ...
著者Jensen, J.K, Morth, J.P.
登録日2010-12-15
公開日2011-06-22
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Crystal structure of plasminogen activator inhibitor-1 in an active conformation with normal thermodynamic stability.
J.Biol.Chem., 286, 2011
3Q3T
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BU of 3q3t by Molmil
Alkyl Amine Renin Inhibitors: Filling S1 from S3
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, GLYCEROL, ...
著者Wu, Z, McKeever, B.
登録日2010-12-22
公開日2011-08-03
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Biphenyl/diphenyl ether renin inhibitors: Filling the S1 pocket of renin via the S3 pocket.
Bioorg.Med.Chem.Lett., 21, 2011
4FAF
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BU of 4faf by Molmil
Substrate CA/p2 in Complex with a Human Immunodeficiency Virus Type 1 Protease Variant
分子名称: HIV-1 protease, substrate CA/p2 peptide
著者Wang, Y, Dewdney, T.G, Liu, Z, Reiter, S.J, Brunzelle, J.S, Kovari, I.A, Kovari, L.C.
登録日2012-05-22
公開日2012-08-29
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Higher Desolvation Energy Reduces Molecular Recognition in Multi-Drug Resistant HIV-1 Protease.
Biology (Basel), 1, 2012
4FB2
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BU of 4fb2 by Molmil
Crystal Structure of Substrate-Free P450cin
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, P450cin, ...
著者Madrona, Y, Tripathi, S.M, Li, H, Poulos, T.L.
登録日2012-05-22
公開日2012-07-18
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.37 Å)
主引用文献Crystal structures of substrate-free and nitrosyl cytochrome p450cin: implications for o(2) activation.
Biochemistry, 51, 2012
3PI3
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BU of 3pi3 by Molmil
Crystallographic Structure of HbII-oxy from Lucina pectinata at pH 5.0
分子名称: Hemoglobin II, OXYGEN MOLECULE, PROTOPORPHYRIN IX CONTAINING FE
著者Gavira, J.A, Nieves-Marrero, C.A, Ruiz-Martinez, C.R, Estremera-Andujar, R.A, Lopez-Garriga, J, Garcia-Ruiz, J.M.
登録日2010-11-05
公開日2011-11-09
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献pH-dependence crystallographic studies of the oxygen carrier hemoglobin II from Lucina pectinata
To be Published
4F5B
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BU of 4f5b by Molmil
Triple mutant Src SH2 domain bound to phosphotyrosine
分子名称: O-PHOSPHOTYROSINE, Proto-oncogene tyrosine-protein kinase Src
著者Kaneko, T, Huang, H, Cao, X, Li, C, Voss, C, Sidhu, S.S, Li, S.S.
登録日2012-05-12
公開日2012-10-03
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.57 Å)
主引用文献Superbinder SH2 Domains Act as Antagonists of Cell Signaling.
Sci.Signal., 5, 2012
4F6B
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Aquomet structure of His100Phe Cerebratulus lacteus mini-hemoglobin
分子名称: GLYCEROL, Neural hemoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
著者Soman, J, Salter, M.D, Olson, J.S.
登録日2012-05-14
公開日2012-05-30
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.64 Å)
主引用文献Aquomet structure of His100Phe Cerebratulus lacteus mini-hemoglobin
To be Published

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