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8T59
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BU of 8t59 by Molmil
Crystal structure of Para.09 bound to TREM2
分子名称: DI(HYDROXYETHYL)ETHER, GLYCEROL, Para.09 heavy chain, ...
著者Wallweber, H, Hsu, P.L.
登録日2023-06-12
公開日2024-07-31
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Rapid affinity optimization of an anti-TREM2 clinical lead antibody by cross-lineage immune repertoire mining
To Be Published
8TRV
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BU of 8trv by Molmil
Structure of the EphA2 LBDCRD bound to FabS1C_C1
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Ephrin type-A receptor 2, ...
著者Singer, A.U, Bruce, H.A, Blazer, L, Adams, J.J, Sicheri, F, Sidhu, S.S.
登録日2023-08-10
公開日2024-07-17
実験手法X-RAY DIFFRACTION (3.25 Å)
主引用文献Synthetic Antibodies targeting EPHA2 Induce Diverse Signaling-Competent Clusters with Differential Activation
To be Published
6DBZ
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BU of 6dbz by Molmil
Crystal structure of Nudix 1 from Arabidopsis thaliana complexed with isopentenyl diphosphate
分子名称: ISOPENTYL PYROPHOSPHATE, MAGNESIUM ION, Nudix hydrolase 1
著者Noel, J.P, Thomas, S.T, Dudareva, N, Henry, L.K.
登録日2018-05-03
公開日2018-09-19
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Contribution of isopentenyl phosphate to plant terpenoid metabolism.
Nat Plants, 4, 2018
6DC1
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BU of 6dc1 by Molmil
Directed evolutionary changes in Kemp Eliminase KE07 - Crystal 25 round 7
分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 5-nitro-2-oxidanyl-benzenecarbonitrile, ...
著者Jackson, C.J, Hong, N.-S, Carr, P.D.
登録日2018-05-03
公開日2018-08-01
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.68 Å)
主引用文献The evolution of multiple active site configurations in a designed enzyme.
Nat Commun, 9, 2018
8TRR
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BU of 8trr by Molmil
T cell recognition of citrullinated vimentin peptide presented by HLA-DR4
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, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Loh, T.J, Lim, J.J, Reid, H.H, Rossjohn, J.
登録日2023-08-10
公開日2024-07-31
最終更新日2024-08-07
実験手法X-RAY DIFFRACTION (2.65 Å)
主引用文献The molecular basis underlying T cell specificity towards citrullinated epitopes presented by HLA-DR4.
Nat Commun, 15, 2024
5TG0
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BU of 5tg0 by Molmil
Crystal structure of the dimethylsulfoniopropionate (DMSP) lyase DddK complexed with iron and zinc
分子名称: FE (III) ION, ZINC ION, dimethylsulfoniopropionate lyase DddK
著者Schnicker, N.J, Dey, M.
登録日2016-09-27
公開日2017-06-14
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.44 Å)
主引用文献Structural and Biochemical Insights into Dimethylsulfoniopropionate Cleavage by Cofactor-Bound DddK from the Prolific Marine Bacterium Pelagibacter.
Biochemistry, 56, 2017
6DKE
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BU of 6dke by Molmil
The X-ray crystal structure of Streptococcus pneumoniae Fatty Acid Kinase (Fak) B1 protein loaded with palmitic acid (C16:0) to 1.76 Angstrom resolution
分子名称: Fatty Acid Kinase (Fak) B1 protein, PALMITIC ACID
著者Cuypers, M.G, Subramanian, C, White, S.W, Rock, C.O.
登録日2018-05-29
公開日2019-05-29
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.76 Å)
主引用文献The X-ray crystal structure of Streptococcus pneumoniae Fatty Acid Kinase (Fak) B1 protein loaded with palmitic acid (C16:0) to 1.76 Angstrom resolution
To Be Published
8TTT
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BU of 8ttt by Molmil
Structure of SNX27 FERM complexed with Fam21A repeat 15 (1124-1140)
分子名称: DI(HYDROXYETHYL)ETHER, Fam21A repeat 15 peptide, GLYCEROL, ...
著者Guo, Q, Chen, K.-E, Collins, B.M.
登録日2023-08-15
公開日2024-08-21
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Structural basis for coupling of the WASH subunit FAM21 with the endosomal SNX27-Retromer complex.
Proc.Natl.Acad.Sci.USA, 121, 2024
6IFF
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BU of 6iff by Molmil
Crystal structure of M1 zinc metallopeptidase E323A mutant from Deinococcus radiodurans
分子名称: SODIUM ION, TYROSINE, ZINC ION, ...
著者Agrawal, R, Kumar, A, Kumar, A, Gaur, N.K, Makde, R.D.
登録日2018-09-20
公開日2019-09-25
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.83 Å)
主引用文献Structural basis for the unusual substrate specificity of unique two-domain M1 metallopeptidase.
Int.J.Biol.Macromol., 147, 2020
6DG5
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BU of 6dg5 by Molmil
Structure of a de novo designed Interleukin-2/Interleukin-15 mimetic complex with IL-2Rb and IL-2Rg
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, Cytokine receptor common subunit gamma, ...
著者Jude, K.M, Silva, D.-A, Yu, S, Baker, D, Garcia, K.C.
登録日2018-05-16
公開日2019-01-16
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.516 Å)
主引用文献De novo design of potent and selective mimics of IL-2 and IL-15.
Nature, 565, 2019
5G01
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BU of 5g01 by Molmil
An unusual natural product primary sulfonamide: synthesis, carbonic anhydrase inhibition and protein x-ray structure of Psammaplin C
分子名称: CARBONIC ANHYDRASE 2, PSAMMAPLIN C, SODIUM ION, ...
著者Mujumdar, P, Supuran, C.T, Peat, T.S, Poulsen, S.A.
登録日2016-03-16
公開日2016-05-25
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献An Unusual Natural Product Primary Sulfonamide: Synthesis, Carbonic Anhydrase Inhibition and Protein X-Ray Structures of Psammaplin C.
J.Med.Chem., 59, 2016
8TQF
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BU of 8tqf by Molmil
Crystal structure of Soybean SHMT8 in complex with PLP-glycine and diglutamylated 5-formyltetrahydrofolate
分子名称: 1,2-ETHANEDIOL, N-GLYCINE-[3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL-PYRIDIN-4-YL-METHANE], N-[4-({[(6R)-2-amino-5-formyl-4-hydroxy-5,6,7,8-tetrahydropteridin-6-yl]methyl}amino)benzoyl]-L-gamma-glutamyl-L-glutamic acid, ...
著者Owuocha, L.F, Beamer, L.J.
登録日2023-08-07
公開日2024-08-21
実験手法X-RAY DIFFRACTION (1.69 Å)
主引用文献Structural insights into high affinity binding of polyglutamylated tetrahydrofolate to soybean serine hydroxymethyltransferase
To Be Published
5FNR
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BU of 5fnr by Molmil
Structure of the Keap1 Kelch domain in complex with a small molecule inhibitor.
分子名称: (3S)-3-(4-chlorophenyl)-3-(1-methylbenzotriazol-5-yl)propanoic acid, KELCH-LIKE ECH-ASSOCIATED PROTEIN 1
著者Davies, T.G, Wixted, W.E, Coyle, J.E, Griffiths-Jones, C, Hearn, K, McMenamin, R, Norton, D, Rich, S.J, Richardson, C, Saxty, G, Willems, H.M.G, Woolford, A.J, Cottom, J.E, Kou, J, Yonchuk, J.G, Feldser, H.G, Sanchez, Y, Foley, J.P, Bolognese, B.J, Logan, G, Podolin, P.L, Yan, H, Callahan, J.F, Heightman, T.D, Kerns, J.K.
登録日2015-11-16
公開日2016-04-13
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.89 Å)
主引用文献Mono-Acidic Inhibitors of the Kelch-Like Ech-Associated Protein 1 : Nuclear Factor Erythroid 2-Related Factor 2 (Keap1:Nrf2) Protein-Protein Interaction with High Cell Potency Identified by Fragment-Based Discovery.
J.Med.Chem., 59, 2016
6KGL
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BU of 6kgl by Molmil
LSD1-CoREST-S2101 N5 adduct model
分子名称: 3-[3,5-bis(fluoranyl)-2-phenylmethoxy-phenyl]propanal, FLAVIN-ADENINE DINUCLEOTIDE, GLYCEROL, ...
著者Niwa, H, Sato, S, Sengoku, S, Umehara, T, Yokoyama, S.
登録日2019-07-12
公開日2020-03-25
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Development and Structural Evaluation of N-Alkylated trans-2-Phenylcyclopropylamine-Based LSD1 Inhibitors.
Chemmedchem, 15, 2020
5WZT
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BU of 5wzt by Molmil
Crystal structure of human secreted phospholipase A2 group IIE with Compound 14
分子名称: 2-[1-[(3-bromophenyl)methyl]-2-methyl-3-oxamoyl-indol-4-yl]oxyethanoic acid, CALCIUM ION, DIMETHYL SULFOXIDE, ...
著者Hou, S, Xu, J, Xu, T, Liu, J.
登録日2017-01-18
公開日2018-01-24
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structural basis for functional selectivity and ligand recognition revealed by crystal structures of human secreted phospholipase A2 group IIE
Sci Rep, 7, 2017
8TTV
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BU of 8ttv by Molmil
Structure of SNX27 FERM complexed with Fam21A repeat 20 (1289-1302)
分子名称: DI(HYDROXYETHYL)ETHER, Fam21A repeat 20 peptide, Sorting nexin-27
著者Guo, Q, Chen, K.-E, Collins, B.M.
登録日2023-08-15
公開日2024-08-21
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structural basis for coupling of the WASH subunit FAM21 with the endosomal SNX27-Retromer complex.
Proc.Natl.Acad.Sci.USA, 121, 2024
7LTD
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BU of 7ltd by Molmil
X-ray radiation damage series on Proteinase K at 100K, crystal structure, dataset 1
分子名称: CALCIUM ION, NITRATE ION, Proteinase K
著者Yabukarski, F, Doukov, T, Herschlag, D.
登録日2021-02-19
公開日2022-08-17
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (0.9 Å)
主引用文献Evaluating the impact of X-ray damage on conformational heterogeneity in room-temperature (277 K) and cryo-cooled protein crystals.
Acta Crystallogr D Struct Biol, 78, 2022
6JW9
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BU of 6jw9 by Molmil
Crystal structure of E-64 inhibited falcipain 2 from Plasmodium falciparum, strain 3D7
分子名称: Cysteine protease falcipain-2, N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-BUTYL]-GUANIDINE
著者Chakraborty, S, Alam, B, Biswas, S.
登録日2019-04-18
公開日2020-04-22
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (3.5 Å)
主引用文献New insights of falcipain 2 structure from Plasmodium falciparum 3D7 strain.
Biochem.Biophys.Res.Commun., 590, 2022
8TOZ
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BU of 8toz by Molmil
Class III PreQ1 riboswitch double mutant U8C/A85G
分子名称: 7-DEAZA-7-AMINOMETHYL-GUANINE, Class-III preQ1 riboswitch
著者Srivastava, Y, Jenkins, J.L, Wedekind, J.E.
登録日2023-08-04
公開日2024-08-07
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献New insights into Class III PreQ1 metabolite binding
To Be Published
5FTH
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BU of 5fth by Molmil
Crystal structure of the GluA2 K738M-T744K LBD in complex with glutamate (zinc form)
分子名称: GLUTAMATE RECEPTOR 2, GLUTAMIC ACID, ZINC ION
著者Nayeem, N, Green, T.
登録日2016-01-13
公開日2016-02-03
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Distinct Structural Pathways Coordinate the Activation of Ampa Receptor-Auxiliary Subunit Complexes.
Neuron, 89, 2016
6DOB
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BU of 6dob by Molmil
Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with an RNA/DNA Hybrid: Reaction in 2 mM Mg2+ and 200 mM K+ for 200 s at 21 C
分子名称: 1,2-ETHANEDIOL, DNA (5'-D(*CP*GP*AP*TP*GP*T)-3'), GLYCEROL, ...
著者Samara, N.L, Yang, W.
登録日2018-06-09
公開日2018-08-15
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.343 Å)
主引用文献Cation trafficking propels RNA hydrolysis.
Nat. Struct. Mol. Biol., 25, 2018
7LTI
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BU of 7lti by Molmil
X-ray radiation damage series on Proteinase K at 100K, crystal structure, dataset 2
分子名称: CALCIUM ION, NITRATE ION, Proteinase K
著者Yabukarski, F, Doukov, T, Herschlag, D.
登録日2021-02-19
公開日2022-08-17
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (0.91 Å)
主引用文献Evaluating the impact of X-ray damage on conformational heterogeneity in room-temperature (277 K) and cryo-cooled protein crystals.
Acta Crystallogr D Struct Biol, 78, 2022
7LTV
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BU of 7ltv by Molmil
X-ray radiation damage series on Proteinase K at 100K, crystal structure, dataset 3
分子名称: CALCIUM ION, NITRATE ION, Proteinase K
著者Yabukarski, F, Doukov, T, Herschlag, D.
登録日2021-02-20
公開日2022-08-17
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (0.95 Å)
主引用文献Evaluating the impact of X-ray damage on conformational heterogeneity in room-temperature (277 K) and cryo-cooled protein crystals.
Acta Crystallogr D Struct Biol, 78, 2022
6DOL
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BU of 6dol by Molmil
Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with an RNA/DNA Hybrid: Reaction in 2 mM Mg2+ and 25 mM K+ for 120 s at 21 C (dataset 2)
分子名称: 1,2-ETHANEDIOL, 5'-R(*AP*CP*AP*U)-3' portion of intact RNA (5'-R(*AP*CP*AP*UP*CP*G)-3'), 5'-R(P*CP*G)-3' portion of intact RNA (5'-R(*AP*CP*AP*UP*CP*G)-3'), ...
著者Samara, N.L, Yang, W.
登録日2018-06-09
公開日2018-08-15
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.433 Å)
主引用文献Cation trafficking propels RNA hydrolysis.
Nat. Struct. Mol. Biol., 25, 2018
7LU0
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BU of 7lu0 by Molmil
X-ray radiation damage series on Proteinase K at 100K, crystal structure, dataset 4
分子名称: CALCIUM ION, NITRATE ION, Proteinase K
著者Yabukarski, F, Doukov, T, Herschlag, D.
登録日2021-02-20
公開日2022-08-17
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.01 Å)
主引用文献Evaluating the impact of X-ray damage on conformational heterogeneity in room-temperature (277 K) and cryo-cooled protein crystals.
Acta Crystallogr D Struct Biol, 78, 2022

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件を2024-08-28に公開中

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