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6HEF
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BU of 6hef by Molmil
Room temperature structure of the (SR)Ca2+-ATPase Ca2-E1-CaAMPPCP form
分子名称: 1,2-DIOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, CALCIUM ION, PHOSPHOMETHYLPHOSPHONIC ACID ADENYLATE ESTER, ...
著者Hjorth-Jensen, S, Sorensen, T.L.M, Oksanen, E, Andersen, J.L, Olesen, C, Moller, J.V, Nissen, P.
登録日2018-08-20
公開日2018-08-29
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (3.538 Å)
主引用文献Membrane-protein crystals for neutron diffraction.
Acta Crystallogr D Struct Biol, 74, 2018
7ABX
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BU of 7abx by Molmil
Perdeuterated E65Q-TIM complexed with 2-PHOSPHOGLYCOLIC ACID
分子名称: 2-PHOSPHOGLYCOLIC ACID, Triosephosphate isomerase
著者Kelpsas, V, Caldararu, O, von Wachenfeldt, C, Oksanen, E.
登録日2020-09-09
公開日2021-07-28
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.2 Å)
主引用文献Neutron structures of Leishmania mexicana triosephosphate isomerase in complex with reaction-intermediate mimics shed light on the proton-shuttling steps.
Iucrj, 8, 2021
7AZ9
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BU of 7az9 by Molmil
Perdeuterated E65Q-TIM complexed with PHOSPHOGLYCOLOHYDROXAMATE
分子名称: PHOSPHOGLYCOLOHYDROXAMIC ACID, Triosephosphate isomerase
著者Kelpsas, V, Caldararu, O, von Wachenfeldt, C, Oksanen, E.
登録日2020-11-16
公開日2021-07-28
最終更新日2024-05-01
実験手法NEUTRON DIFFRACTION (1.1 Å), X-RAY DIFFRACTION
主引用文献Neutron structures of Leishmania mexicana triosephosphate isomerase in complex with reaction-intermediate mimics shed light on the proton-shuttling steps.
Iucrj, 8, 2021
7AZA
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BU of 7aza by Molmil
Perdeuterated E65Q-TIM complexed with PHOSPHOGLYCOLOHYDROXAMATE
分子名称: PHOSPHOGLYCOLOHYDROXAMIC ACID, Triosephosphate isomerase
著者Kelpsas, V, Caldararu, O, von Wachenfeldt, C, Oksanen, E.
登録日2020-11-16
公開日2021-07-28
最終更新日2024-05-01
実験手法NEUTRON DIFFRACTION (1.1 Å), X-RAY DIFFRACTION
主引用文献Neutron structures of Leishmania mexicana triosephosphate isomerase in complex with reaction-intermediate mimics shed light on the proton-shuttling steps.
Iucrj, 8, 2021
7AZ4
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BU of 7az4 by Molmil
Perdeuterated E65Q-TIM complexed with 2-PHOSPHOGLYCOLIC ACID
分子名称: 2-PHOSPHOGLYCOLIC ACID, Triosephosphate isomerase
著者Kelpsas, V, Caldararu, O, von Wachenfeldt, C, Oksanen, E.
登録日2020-11-16
公開日2021-07-28
最終更新日2024-05-01
実験手法NEUTRON DIFFRACTION (1.15 Å), X-RAY DIFFRACTION
主引用文献Neutron structures of Leishmania mexicana triosephosphate isomerase in complex with reaction-intermediate mimics shed light on the proton-shuttling steps.
Iucrj, 8, 2021
7AZ3
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BU of 7az3 by Molmil
Perdeuterated E65Q-TIM complexed with 2-PHOSPHOGLYCOLIC ACID
分子名称: 2-PHOSPHOGLYCOLIC ACID, Triosephosphate isomerase
著者Kelpsas, V, Caldararu, O, von Wachenfeldt, C, Oksanen, E.
登録日2020-11-16
公開日2021-07-28
最終更新日2024-05-01
実験手法NEUTRON DIFFRACTION (1.15 Å), X-RAY DIFFRACTION
主引用文献Neutron structures of Leishmania mexicana triosephosphate isomerase in complex with reaction-intermediate mimics shed light on the proton-shuttling steps.
Iucrj, 8, 2021
4KFR
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BU of 4kfr by Molmil
Structure of the genome packaging NTPase B204 from Sulfolobus turreted icosahedral virus 2 in complex with sulfate
分子名称: Genome packaging NTPase B204, MAGNESIUM ION, SULFATE ION
著者Happonen, L.J, Oksanen, E, Goldman, A, Kajander, T, Butcher, S.
登録日2013-04-27
公開日2013-05-22
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.956 Å)
主引用文献The Structure of the NTPase That Powers DNA Packaging into Sulfolobus Turreted Icosahedral Virus 2.
J.Virol., 87, 2013
4KFS
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BU of 4kfs by Molmil
Structure of the genome packaging NTPase B204 from Sulfolobus turreted icosahedral virus 2 in complex with AMP
分子名称: ADENOSINE MONOPHOSPHATE, CITRATE ANION, Genome packaging NTPase B204, ...
著者Happonen, L.J, Oksanen, E, Kajander, T, Goldman, A, Butcher, S.
登録日2013-04-27
公開日2013-05-22
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.946 Å)
主引用文献The Structure of the NTPase That Powers DNA Packaging into Sulfolobus Turreted Icosahedral Virus 2.
J.Virol., 87, 2013
4KFT
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BU of 4kft by Molmil
Structure of the genome packaging NTPase B204 from Sulfolobus turreted icosahedral virus 2 in complex with ATP-gammaS
分子名称: CHLORIDE ION, CITRATE ANION, Genome packaging NTPase B204, ...
著者Happonen, L.J, Oksanen, E, Kajander, T, Goldman, A, Butcher, S.
登録日2013-04-27
公開日2013-05-22
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.241 Å)
主引用文献The Structure of the NTPase That Powers DNA Packaging into Sulfolobus Turreted Icosahedral Virus 2.
J.Virol., 87, 2013
4KFU
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BU of 4kfu by Molmil
Structure of the genome packaging NTPase B204 from Sulfolobus turreted icosahedral virus 2 in complex with AMPPCP
分子名称: CITRATE ANION, Genome packaging NTPase B204, MAGNESIUM ION, ...
著者Happonen, L.J, Oksanen, E, Kajander, T, Goldman, A, Butcher, S.
登録日2013-04-27
公開日2013-05-22
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.892 Å)
主引用文献The Structure of the NTPase That Powers DNA Packaging into Sulfolobus Turreted Icosahedral Virus 2.
J.Virol., 87, 2013
2AWW
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BU of 2aww by Molmil
Synapse associated protein 97 PDZ2 domain variant C378G with C-terminal GluR-A peptide
分子名称: 18-residue C-terminal peptide from glutamate receptor, ionotropic, AMPA1, ...
著者Von Ossowski, I, Oksanen, E, Von Ossowski, L, Cai, C, Sundberg, M, Goldman, A, Keinanen, K.
登録日2005-09-02
公開日2006-08-29
最終更新日2021-11-10
実験手法X-RAY DIFFRACTION (2.21 Å)
主引用文献Crystal structure of the second PDZ domain of SAP97 in complex with a GluR-A C-terminal peptide
Febs J., 273, 2006
2AWX
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BU of 2awx by Molmil
Synapse associated protein 97 PDZ2 domain variant C378S
分子名称: HISTIDINE, Synapse associated protein 97
著者Von Ossowski, I, Oksanen, E, Von Ossowski, L, Cai, C, Sundberg, M, Goldman, A, Keinanen, K.
登録日2005-09-02
公開日2006-08-29
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal structure of the second PDZ domain of SAP97 in complex with a GluR-A C-terminal peptide
Febs J., 273, 2006
2AWU
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BU of 2awu by Molmil
Synapse associated protein 97 PDZ2 domain variant C378G
分子名称: AHH, Synapse-associated protein 97
著者Von Ossowski, I, Oksanen, E, Von Ossowski, L, Cai, C, Sundberg, M, Goldman, A, Keinanen, K.
登録日2005-09-02
公開日2006-08-29
最終更新日2021-11-10
実験手法X-RAY DIFFRACTION (2.44 Å)
主引用文献Crystal structure of the second PDZ domain of SAP97 in complex with a GluR-A C-terminal peptide
Febs J., 273, 2006
2J6X
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BU of 2j6x by Molmil
The crystal structure of lactate oxidase
分子名称: FLAVIN MONONUCLEOTIDE, LACTATE OXIDASE, ZINC ION
著者Leiros, I, Wang, E, Rasmussen, T, Oksanen, E, Repo, H, Petersen, S.B, Heikinheimo, P, Hough, E.
登録日2006-10-05
公開日2006-10-23
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献The 2.1 A Structure of Aerococcus Viridans L-Lactate Oxidase (Lox).
Acta Crystallogr.,Sect.F, 62, 2006
6QGE
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BU of 6qge by Molmil
Galectin-3C in complex with a pair of enantiomeric ligands: S enantiomer
分子名称: (2~{S},3~{R},4~{S},5~{R},6~{R})-4-[4-(3-fluorophenyl)-1,2,3-triazol-1-yl]-2-[(2~{S})-3-[4-(3-fluorophenyl)-1,2,3-triazol-1-yl]-2-oxidanyl-propyl]sulfanyl-6-(hydroxymethyl)oxane-3,5-diol, Galectin-3
著者Manzoni, F, Verteramo, M.L, Oksanen, E, Nilsson, U.J, Logan, D.T.
登録日2019-01-11
公開日2019-01-23
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.16 Å)
主引用文献Interplay between Conformational Entropy and Solvation Entropy in Protein-Ligand Binding.
J. Am. Chem. Soc., 141, 2019
6QGF
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BU of 6qgf by Molmil
Galectin-3C in complex with a pair of enantiomeric ligands: R enantiomer
分子名称: (2~{S},3~{R},4~{S},5~{R},6~{R})-4-[4-(3-fluorophenyl)-1,2,3-triazol-1-yl]-2-[(2~{R})-3-[4-(3-fluorophenyl)-1,2,3-triazol-1-yl]-2-oxidanyl-propyl]sulfanyl-6-(hydroxymethyl)oxane-3,5-diol, Galectin-3
著者Manzoni, F, Verteramo, M.L, Oksanen, E, Nilsson, U.J, Logan, D.T.
登録日2019-01-11
公開日2019-01-23
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.34 Å)
主引用文献Interplay between Conformational Entropy and Solvation Entropy in Protein-Ligand Binding.
J. Am. Chem. Soc., 141, 2019
2IW4
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BU of 2iw4 by Molmil
CRYSTAL STRUCTURE OF BASILLUS SUBTILIS FAMILY II INORGANIC PYROPHOSPHATASE MUTANT, H98Q, IN COMPLEX WITH PNP
分子名称: FE (III) ION, GLYCEROL, IMIDODIPHOSPHORIC ACID, ...
著者Fabrichniy, I.P, Lehtio, L, Oksanen, E, Goldman, A.
登録日2006-06-26
公開日2006-11-07
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献A Trimetal Site and Substrate Distortion in a Family II Inorganic Pyrophosphatase.
J.Biol.Chem., 282, 2007
5LS0
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BU of 5ls0 by Molmil
Crystal structure of Inorganic Pyrophosphatase PPA1 from Arabidopsis thaliana
分子名称: DI(HYDROXYETHYL)ETHER, MAGNESIUM ION, Soluble inorganic pyrophosphatase 1
著者Grzechowiak, M, Sikorski, M, Jaskolski, M.
登録日2016-08-22
公開日2017-09-13
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.83 Å)
主引用文献Crystal structures of plant inorganic pyrophosphatase, an enzyme with a moonlighting autoproteolytic activity.
Biochem.J., 476, 2019
6RZG
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BU of 6rzg by Molmil
Galectin-3C in complex with meta-fluoroaryltriazole galactopyranosyl 1-thio-D-glucopyranoside derivative
分子名称: (2~{S},3~{R},4~{S},5~{S},6~{R})-2-[(2~{S},3~{R},4~{S},5~{R},6~{R})-4-[4-(3-fluorophenyl)-1,2,3-triazol-1-yl]-6-(hydroxymethyl)-3,5-bis(oxidanyl)oxan-2-yl]sulfanyl-6-(hydroxymethyl)oxane-3,4,5-triol, CHLORIDE ION, Galectin-3
著者Kumar, R, Peterson, K, Nilsson, U.J, Logan, D.T.
登録日2019-06-13
公開日2020-07-08
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.015 Å)
主引用文献Entropy-Entropy Compensation between the Protein, Ligand, and Solvent Degrees of Freedom Fine-Tunes Affinity in Ligand Binding to Galectin-3C.
Jacs Au, 1, 2021
6RZF
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BU of 6rzf by Molmil
Galectin-3C in complex with ortho-fluoroaryltriazole galactopyranosyl 1-thio-D-glucopyranoside derivative
分子名称: (2~{S},3~{R},4~{S},5~{S},6~{R})-2-[(2~{S},3~{R},4~{S},5~{R},6~{R})-4-[4-(2-fluorophenyl)-1,2,3-triazol-1-yl]-6-(hydroxymethyl)-3,5-bis(oxidanyl)oxan-2-yl]sulfanyl-6-(hydroxymethyl)oxane-3,4,5-triol, Galectin-3
著者Kumar, R, Peterson, K, Nilsson, U.J, Logan, D.T.
登録日2019-06-13
公開日2020-07-08
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.016 Å)
主引用文献Entropy-Entropy Compensation between the Protein, Ligand, and Solvent Degrees of Freedom Fine-Tunes Affinity in Ligand Binding to Galectin-3C.
Jacs Au, 1, 2021
6RHL
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BU of 6rhl by Molmil
Room temperature data of Galectin-3C in complex with a pair of enantiomeric ligands: R enantiomer
分子名称: (2~{S},3~{R},4~{S},5~{R},6~{R})-4-[4-(3-fluorophenyl)-1,2,3-triazol-1-yl]-2-[(2~{R})-3-[4-(3-fluorophenyl)-1,2,3-triazol-1-yl]-2-oxidanyl-propyl]sulfanyl-6-(hydroxymethyl)oxane-3,5-diol, Galectin-3
著者Kumar, R, Verteramo, M.L, Nilsson, U.J, Logan, D.T.
登録日2019-04-22
公開日2019-08-21
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.299 Å)
主引用文献Are crystallographic B-factors suitable for calculating protein conformational entropy?
Phys Chem Chem Phys, 21, 2019
6RHM
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BU of 6rhm by Molmil
Room temperature data of Galectin-3C in complex with a pair of enantiomeric ligands: S enantiomer
分子名称: (2~{S},3~{R},4~{S},5~{R},6~{R})-4-[4-(3-fluorophenyl)-1,2,3-triazol-1-yl]-2-[(2~{S})-3-[4-(3-fluorophenyl)-1,2,3-triazol-1-yl]-2-oxidanyl-propyl]sulfanyl-6-(hydroxymethyl)oxane-3,5-diol, Galectin-3
著者Kumar, R, Verteramo, M.L, Nilsson, U.J, Logan, D.T.
登録日2019-04-22
公開日2019-08-21
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.596 Å)
主引用文献Are crystallographic B-factors suitable for calculating protein conformational entropy?
Phys Chem Chem Phys, 21, 2019
6RZH
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BU of 6rzh by Molmil
Galectin-3C in complex with para-fluoroaryltriazole galactopyranosyl 1-thio-D-glucopyranoside derivative
分子名称: (2~{S},3~{R},4~{S},5~{S},6~{R})-2-[(2~{S},3~{R},4~{S},5~{R},6~{R})-4-[4-(4-fluorophenyl)-1,2,3-triazol-1-yl]-6-(hydroxymethyl)-3,5-bis(oxidanyl)oxan-2-yl]sulfanyl-6-(hydroxymethyl)oxane-3,4,5-triol, CHLORIDE ION, Galectin-3
著者Kumar, R, Peterson, K, Nilsson, U.J, Logan, D.T.
登録日2019-06-13
公開日2020-07-08
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (0.947 Å)
主引用文献Entropy-Entropy Compensation between the Protein, Ligand, and Solvent Degrees of Freedom Fine-Tunes Affinity in Ligand Binding to Galectin-3C.
Jacs Au, 1, 2021
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