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4M2Q
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BU of 4m2q by Molmil
Crystal structure of non-myristoylated recoverin with Cysteine-39 oxidized to sulfenic acid
分子名称: CALCIUM ION, Recoverin
著者Prem Kumar, R, Chakrabarti, K, Kern, D, Oprian, D.D.
登録日2013-08-05
公開日2013-11-13
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献A Highly Conserved Cysteine of Neuronal Calcium-sensing Proteins Controls Cooperative Binding of Ca2+ to Recoverin.
J.Biol.Chem., 288, 2013
6EXY
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BU of 6exy by Molmil
Neutron crystal structure of perdeuterated galectin-3C in complex with glycerol
分子名称: GLYCEROL, Galectin-3
著者Manzoni, F, Schrader, T.E, Ostermann, A, Oksanen, E, Logan, D.T.
登録日2017-11-10
公開日2018-09-12
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Elucidation of Hydrogen Bonding Patterns in Ligand-Free, Lactose- and Glycerol-Bound Galectin-3C by Neutron Crystallography to Guide Drug Design.
J. Med. Chem., 61, 2018
4M2O
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BU of 4m2o by Molmil
Crystal structure of a non-myristoylated C39A recoverin mutant with one calcium ion bound to EF-hand 3
分子名称: CALCIUM ION, Recoverin
著者Prem Kumar, R, Ranaghan, M.J, Oprian, D.D.
登録日2013-08-05
公開日2013-11-13
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献A Highly Conserved Cysteine of Neuronal Calcium-sensing Proteins Controls Cooperative Binding of Ca2+ to Recoverin.
J.Biol.Chem., 288, 2013
4M2P
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BU of 4m2p by Molmil
Crystal structure of a non-myristoylated C39D recoverin mutant with one calcium ion bound to EF-hand 3
分子名称: CALCIUM ION, Recoverin
著者Prem Kumar, R, Ranaghan, M.J, Oprian, D.D.
登録日2013-08-05
公開日2013-11-13
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献A Highly Conserved Cysteine of Neuronal Calcium-sensing Proteins Controls Cooperative Binding of Ca2+ to Recoverin.
J.Biol.Chem., 288, 2013
5JPV
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BU of 5jpv by Molmil
Efficient targeting of the asialoglycoprotein receptor by polyvalent display of a compact galactoseamine mimic
分子名称: Asialoglycoprotein receptor 1, CALCIUM ION, CHLORIDE ION, ...
著者Liu, S.
登録日2016-05-04
公開日2017-06-14
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Efficient Liver Targeting by Polyvalent Display of a Compact Ligand for the Asialoglycoprotein Receptor.
J. Am. Chem. Soc., 139, 2017
7QGV
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BU of 7qgv by Molmil
Solid-state NMR structure of Teixobactin-Lipid II.
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-N-acetyl-alpha-muramic acid, 3-methylbut-2-en-1-ol, Lipid II, ...
著者Weingarth, M.H, Shukla, R.
登録日2021-12-10
公開日2022-08-03
最終更新日2023-11-15
実験手法SOLID-STATE NMR
主引用文献Teixobactin kills bacteria by a two-pronged attack on the cell envelope.
Nature, 608, 2022
8BJ5
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BU of 8bj5 by Molmil
Imine Reductase IR007 from Amycolatopsis azurea
分子名称: Imine Reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
著者Gilio, A.K, Steflik, J, Grogan, G.
登録日2022-11-03
公開日2023-09-20
実験手法X-RAY DIFFRACTION (2.72 Å)
主引用文献Engineering of a Reductive Aminase to Enable the Synthesis of a Key Intermediate to a CDK 2/4/6 Inhibitor
Acs Catalysis, 13, 2023
8BK1
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BU of 8bk1 by Molmil
Mutant Imine Reductase IR007-143 from Amycolatopsis azurea, E120A, M197W, M206S, A213P, D238G, I240L
分子名称: Mutant Imine Reductase IR007-143 from Amycolatopsis azurea, E120A, M197W, ...
著者Gilio, A.K, Grogan, G.J.
登録日2022-11-08
公開日2023-09-20
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Engineering of a Reductive Aminase to Enable the Synthesis of a Key Intermediate to a CDK 2/4/6 Inhibitor
Acs Catalysis, 13, 2023
8BT3
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BU of 8bt3 by Molmil
Ribonucleotide Reductase class Ie R2 from Mesoplasma florum, catalytically active radical state solved by XFEL
分子名称: Ribonucleoside-diphosphate reductase beta chain
著者Lebrette, H, Srinivas, V, Hogbom, M.
登録日2022-11-27
公開日2023-11-01
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Structure of a ribonucleotide reductase R2 protein radical.
Science, 382, 2023
8BT4
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BU of 8bt4 by Molmil
Ribonucleotide Reductase class Ie R2 from Mesoplasma florum, radical-lost ground state
分子名称: CALCIUM ION, GLYCEROL, Ribonucleoside-diphosphate reductase
著者Lebrette, H, Srinivas, V, Hogbom, M.
登録日2022-11-27
公開日2023-11-01
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献Structure of a ribonucleotide reductase R2 protein radical.
Science, 382, 2023
5UV2
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BU of 5uv2 by Molmil
Crystal Structure of (+)-Limonene Synthase Complexed with 2-Fluoroneryl Diphosphate
分子名称: (+)-limonene synthase, (2E)-2-fluoro-3,7-dimethylocta-2,6-dien-1-yl trihydrogen diphosphate, MANGANESE (II) ION
著者Prem Kumar, R, Malik, K, Oprian, D.D.
登録日2017-02-17
公開日2017-03-22
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structural Characterization of Early Michaelis Complexes in the Reaction Catalyzed by (+)-Limonene Synthase from Citrus sinensis Using Fluorinated Substrate Analogues.
Biochemistry, 56, 2017
5UV0
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BU of 5uv0 by Molmil
Crystal Structure of (+)-Limonene Synthase from Citrus sinensis
分子名称: (+)-limonene synthase
著者Prem Kumar, R, Oprian, D.D.
登録日2017-02-17
公開日2017-03-22
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Functional and Structural Characterization of a (+)-Limonene Synthase from Citrus sinensis.
Biochemistry, 56, 2017
5UV1
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BU of 5uv1 by Molmil
Crystal Structure of (+)-Limonene Synthase Complexed with 2-Fluorogeranyl Diphosphate
分子名称: (+)-limonene synthase, (2Z)-2-fluoro-3,7-dimethylocta-2,6-dien-1-yl trihydrogen diphosphate, MANGANESE (II) ION
著者Prem Kumar, R, Malik, K, Oprian, D.D.
登録日2017-02-17
公開日2017-03-22
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structural Characterization of Early Michaelis Complexes in the Reaction Catalyzed by (+)-Limonene Synthase from Citrus sinensis Using Fluorinated Substrate Analogues.
Biochemistry, 56, 2017
5VYD
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BU of 5vyd by Molmil
Crystal structure of phosphodiesterase domain of RhoPDE fusion protein from the Choanoflagellate Salpingoeca rosetta
分子名称: MAGNESIUM ION, Phosphodiesterase, ZINC ION
著者Prem Kumar, R, Lamarche, L.B, Oprian, D.D.
登録日2017-05-25
公開日2017-10-18
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Purification and Characterization of RhoPDE, a Retinylidene/Phosphodiesterase Fusion Protein and Potential Optogenetic Tool from the Choanoflagellate Salpingoeca rosetta.
Biochemistry, 56, 2017
5OJL
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BU of 5ojl by Molmil
Imine Reductase from Aspergillus terreus in complex with NADPH4 and dibenz[c,e]azepine
分子名称: 1,4,5,6-TETRAHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE PHOSPHATE, 5-methyl-7~{H}-benzo[d][2]benzazepine, Imine reductase
著者Sharma, M, Grogan, G.
登録日2017-07-21
公開日2018-05-30
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.56 Å)
主引用文献Biocatalytic Routes to Enantiomerically Enriched Dibenz[c,e]azepines.
Angew. Chem. Int. Ed. Engl., 56, 2017
6FYX
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BU of 6fyx by Molmil
Structure of a partial yeast 48S preinitiation complex with eIF5 N-terminal domain (model C1)
分子名称: 18S ribosomal RNA, 40S ribosomal protein S0, 40S ribosomal protein S1, ...
著者Llacer, J.L, Hussain, T, Gordiyenko, Y, Ramakrishnan, V.
登録日2018-03-12
公開日2018-12-05
最終更新日2024-04-24
実験手法ELECTRON MICROSCOPY (3.5 Å)
主引用文献Translational initiation factor eIF5 replaces eIF1 on the 40S ribosomal subunit to promote start-codon recognition.
Elife, 7, 2018
4MLW
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BU of 4mlw by Molmil
Crystal structure of non-myristoylated recoverin at 1.45 A resolution with calcium bound to EF-hand 3
分子名称: CALCIUM ION, Recoverin
著者Prem Kumar, R, Ranaghan, M.J, Oprian, D.D.
登録日2013-09-06
公開日2013-11-13
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献A highly conserved cysteine of neuronal calcium-sensing proteins controls cooperative binding of Ca2+ to recoverin.
J.Biol.Chem., 288, 2013
6FYY
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BU of 6fyy by Molmil
Structure of a partial yeast 48S preinitiation complex with eIF5 N-terminal domain (model C2)
分子名称: 18S ribosomal RNA, 40S ribosomal protein S0, 40S ribosomal protein S1, ...
著者Llacer, J.L, Hussain, T, Gordiyenko, Y, Ramakrishnan, V.
登録日2018-03-12
公開日2018-12-05
最終更新日2024-04-24
実験手法ELECTRON MICROSCOPY (3.02 Å)
主引用文献Translational initiation factor eIF5 replaces eIF1 on the 40S ribosomal subunit to promote start-codon recognition.
Elife, 7, 2018
7A3W
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BU of 7a3w by Molmil
Structure of Imine Reductase from Pseudomonas sp.
分子名称: 1,2-ETHANEDIOL, GLYCEROL, NAD(P)-dependent oxidoreductase, ...
著者Cuetos, A, Thorpe, T, Turner, N.J, Grogan, G.
登録日2020-08-18
公開日2021-08-25
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.59 Å)
主引用文献Multifunctional biocatalyst for conjugate reduction and reductive amination.
Nature, 604, 2022
5IM3
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BU of 5im3 by Molmil
Crystal structure of the class I ribonucleotide reductase from Pseudomonas aeruginosa in complex with dATP
分子名称: 2'-DEOXYADENOSINE 5'-TRIPHOSPHATE, MAGNESIUM ION, Ribonucleoside-diphosphate reductase
著者Johansson, R, Logan, D.T.
登録日2016-03-05
公開日2016-05-04
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (2.298 Å)
主引用文献Structural Mechanism of Allosteric Activity Regulation in a Ribonucleotide Reductase with Double ATP Cones.
Structure, 24, 2016
6MAC
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BU of 6mac by Molmil
Ternary structure of GDF11 bound to ActRIIB-ECD and Alk5-ECD
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Activin receptor type-2B, Growth/differentiation factor 11, ...
著者Goebel, E.J, Thompson, T.B.
登録日2018-08-27
公開日2019-07-17
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (2.34 Å)
主引用文献Structural characterization of an activin class ternary receptor complex reveals a third paradigm for receptor specificity.
Proc.Natl.Acad.Sci.USA, 116, 2019
8WES
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BU of 8wes by Molmil
Carbonic Anhydrase II T200V variant 5 atm CO2 pressure (pH 7.8)
分子名称: BICARBONATE ION, Carbonic anhydrase 2, ZINC ION
著者Kim, C.U, Kim, J.K.
登録日2023-09-18
公開日2024-09-18
最終更新日2025-05-21
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献Fast product release requires active-site water dynamics in carbonic anhydrase.
Nat Commun, 16, 2025
8WER
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BU of 8wer by Molmil
Carbonic Anhydrase II T200V variant 0 atm CO2 pressure (pH 7.8)
分子名称: Carbonic anhydrase 2, ZINC ION
著者Kim, C.U, Kim, J.K.
登録日2023-09-18
公開日2024-09-18
最終更新日2025-05-21
実験手法X-RAY DIFFRACTION (1.42 Å)
主引用文献Fast product release requires active-site water dynamics in carbonic anhydrase.
Nat Commun, 16, 2025
8WEP
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BU of 8wep by Molmil
Zn-Carbonic Anhydrase II 5 atm of CO2 pressure (pH 7.8)
分子名称: CARBON DIOXIDE, Carbonic anhydrase 2, GLYCEROL, ...
著者Kim, C.U, Kim, J.K.
登録日2023-09-18
公開日2024-09-18
最終更新日2025-05-21
実験手法X-RAY DIFFRACTION (1.2 Å)
主引用文献Fast product release requires active-site water dynamics in carbonic anhydrase.
Nat Commun, 16, 2025
7Y2M
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BU of 7y2m by Molmil
apo-Carbonic Anhydrase II soaked in 3NPA after UV at 140 K
分子名称: Carbonic anhydrase 2
著者Kim, C.U, Kim, J.K.
登録日2022-06-09
公開日2023-12-20
最終更新日2025-05-21
実験手法X-RAY DIFFRACTION (1.25 Å)
主引用文献Fast product release requires active-site water dynamics in carbonic anhydrase.
Nat Commun, 16, 2025

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