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6TRO
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BU of 6tro by Molmil
Crystal structure of the T-cell receptor GVY01 bound to HLA A2*01-GVYDGREHTV
分子名称: Beta-2-microglobulin, MAGE-A4 peptide (amino acids 230-239), MHC class I antigen, ...
著者Coles, C.H, McMurran, C, Lloyd, A, Hibbert, L, Lupardus, P.J, Cole, D.K, Harper, S.
登録日2019-12-19
公開日2020-06-24
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献T cell receptor interactions with human leukocyte antigen govern indirect peptide selectivity for the cancer testis antigen MAGE-A4.
J.Biol.Chem., 295, 2020
8B8Q
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BU of 8b8q by Molmil
Structure of mTMEM16F in lipid Nanodiscs in the presence of Ca2+
分子名称: Anoctamin-6, CALCIUM ION
著者Arndt, M, Alvadia, C, Straub, M.S, Clerico-Mosina, V, Paulino, C, Dutzler, R.
登録日2022-10-04
公開日2022-12-21
最終更新日2024-11-13
実験手法ELECTRON MICROSCOPY (2.94 Å)
主引用文献Structural basis for the activation of the lipid scramblase TMEM16F.
Nat Commun, 13, 2022
6TUG
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BU of 6tug by Molmil
Enterococcus italicus Csm6 bound to cyclic hexa-2'-fluoro-hexa-dAMP
分子名称: 2'-deoxy-2'-fluoroadenosine 5'-(dihydrogen phosphate), CRISPR system endoribonuclease Csm6, SULFATE ION
著者Garcia-Doval, C, Jinek, M.
登録日2020-01-07
公開日2020-02-26
最終更新日2024-05-15
実験手法X-RAY DIFFRACTION (2.42 Å)
主引用文献Activation and self-inactivation mechanisms of the cyclic oligoadenylate-dependent CRISPR ribonuclease Csm6.
Nat Commun, 11, 2020
6TUN
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BU of 6tun by Molmil
Helicase domain complex
分子名称: CDK-activating kinase assembly factor MAT1, CHLORIDE ION, General transcription and DNA repair factor IIH helicase subunit XPD
著者Sauer, F, Kisker, C.
登録日2020-01-07
公開日2020-11-11
最終更新日2024-05-15
実験手法X-RAY DIFFRACTION (2.07 Å)
主引用文献In TFIIH the Arch domain of XPD is mechanistically essential for transcription and DNA repair.
Nat Commun, 11, 2020
6TRN
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BU of 6trn by Molmil
Crystal structure of HLA A2*01-AVYDGREHTV
分子名称: 1,2-ETHANEDIOL, Beta-2-microglobulin, MAGE-A4 peptide (amino acids 230-239) variant, ...
著者Coles, C.H, McMurran, C, Lloyd, A, Hibbert, L, Lupardus, P.J, Cole, D.K, Harper, S.
登録日2019-12-19
公開日2020-06-24
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献T cell receptor interactions with human leukocyte antigen govern indirect peptide selectivity for the cancer testis antigen MAGE-A4.
J.Biol.Chem., 295, 2020
8BCQ
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BU of 8bcq by Molmil
N-terminal domain of Plasmodium berghei glutamyl-tRNA synthetase (native crystal structure)
分子名称: GLYCEROL, Glutamate--tRNA ligase, SULFATE ION
著者Benas, P, Jaramillo Ponce, J.R, Frugier, M, Sauter, C.
登録日2022-10-17
公開日2023-01-25
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Solution X-ray scattering highlights discrepancies in Plasmodium multi-aminoacyl-tRNA synthetase complexes.
Protein Sci., 32, 2023
2V9T
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BU of 2v9t by Molmil
Complex between the second LRR domain of Slit2 and The first Ig domain from Robo1
分子名称: ROUNDABOUT HOMOLOG 1, SLIT HOMOLOG 2 PROTEIN N-PRODUCT
著者Morlot, C, Cusack, S, McCarthy, A.A.
登録日2007-08-25
公開日2007-09-25
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Structural Insights Into the Slit-Robo Complex.
Proc.Natl.Acad.Sci.USA, 104, 2007
8ZEN
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BU of 8zen by Molmil
Cryo-EM structure of Adr-2-Adbp-1-dsRBD0 complex
分子名称: Adr-2-binding protein 1, Double-stranded RNA-specific adenosine deaminase adr-2, INOSITOL HEXAKISPHOSPHATE, ...
著者Liu, Z.M, Mu, J.Q, Wu, C.
登録日2024-05-06
公開日2025-05-14
実験手法ELECTRON MICROSCOPY (2.99 Å)
主引用文献Cryo-EM structure of Adr-2-Adbp-1-dsRBD0 complex
To Be Published
9JMD
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BU of 9jmd by Molmil
Cryo-EM structure of the Azithromycin-Motilin receptor-Gq protein complex
分子名称: AZITHROMYCIN, CHOLESTEROL, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, ...
著者Xu, H.E, You, C, Jiang, Y.
登録日2024-09-20
公開日2025-05-28
最終更新日2025-06-25
実験手法ELECTRON MICROSCOPY (2.74 Å)
主引用文献Decoding the structural basis of ligand recognition and biased signaling in the motilin receptor.
Cell Rep, 44, 2025
8ZEP
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BU of 8zep by Molmil
Cryo-EM structure of Adr-2-Adbp-1-dsRBD2 complex
分子名称: Adr-2-binding protein 1, Double-stranded RNA-specific adenosine deaminase adr-2, INOSITOL HEXAKISPHOSPHATE, ...
著者Liu, Z.M, Mu, J.Q, Wu, C.
登録日2024-05-06
公開日2025-05-14
実験手法ELECTRON MICROSCOPY (3.29 Å)
主引用文献Cryo-EM structure of Adr-2-Adbp-1-dsRBD2 complex
To Be Published
8ZEO
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BU of 8zeo by Molmil
Cryo-EM structure of Adr-2-Adbp-1-dsRBD1 complex
分子名称: Adr-2-binding protein 1, Double-stranded RNA-specific adenosine deaminase adr-2, INOSITOL HEXAKISPHOSPHATE, ...
著者Liu, Z.M, Mu, J.Q, Wu, C.
登録日2024-05-06
公開日2025-05-14
実験手法ELECTRON MICROSCOPY (2.79 Å)
主引用文献Cryo-EM structure of Adr-2-Adbp-1-dsRBD1 complex
To Be Published
8ZD8
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BU of 8zd8 by Molmil
NMR structure of the (CGG-dsDNA:ND=) 1:1 complex
分子名称: DNA (5'-D(*CP*AP*TP*TP*CP*GP*GP*TP*TP*AP*G)-3'), DNA (5'-D(*CP*TP*AP*AP*CP*GP*GP*AP*AP*TP*G)-3'), ~{N}-(7-methyl-1,8-naphthyridin-2-yl)-3-[[3-[(7-methyl-1,8-naphthyridin-2-yl)amino]-3-oxidanylidene-propyl]amino]propanamide
著者Sakurabayashi, S, Furuita, K, Yamada, T, Nomura, M, Nakatani, K, Kojima, C.
登録日2024-05-01
公開日2025-04-30
実験手法SOLUTION NMR
主引用文献NMR structure of the (CGG-dsDNA:ND=) 1:1 complex
To Be Published
8ZD7
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BU of 8zd7 by Molmil
NMR structure of the CGG-dsDNA-sND complex
分子名称: DNA (5'-D(*CP*AP*TP*TP*CP*GP*GP*TP*TP*AP*G)-3'), DNA (5'-D(*CP*TP*AP*AP*CP*GP*GP*AP*AP*TP*G)-3'), ~{N}-(7-methyl-1,8-naphthyridin-2-yl)-2-[[2-[(7-methyl-1,8-naphthyridin-2-yl)amino]-2-oxidanylidene-ethyl]amino]ethanamide
著者Sakurabayashi, S, Furuita, K, Yamada, T, Nomura, M, Nakatani, K, Kojima, C.
登録日2024-05-01
公開日2025-04-30
実験手法SOLUTION NMR
主引用文献NMR structure of the CGG-dsDNA-sND complex
To Be Published
2VC7
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BU of 2vc7 by Molmil
Structural basis for natural lactonase and promiscuous phosphotriesterase activities
分子名称: (4S)-4-(decanoylamino)-5-hydroxy-3,4-dihydro-2H-thiophenium, 1,2-ETHANEDIOL, ARYLDIALKYLPHOSPHATASE, ...
著者Elias, M, Dupuy, J, Merone, L, Mandrich, L, Moniot, S, Rochu, D, Lecomte, C, Rossi, M, Masson, P, Manco, G, Chabriere, E.
登録日2007-09-19
公開日2008-04-15
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Structural Basis for Natural Lactonase and Promiscuous Phosphotriesterase Activities.
J.Mol.Biol., 379, 2008
8ZD2
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BU of 8zd2 by Molmil
NMR structure of the (CGG-dsDNA:ND=) 1:2 complex
分子名称: DNA (5'-D(*CP*AP*TP*TP*CP*GP*GP*TP*TP*AP*G)-3'), DNA (5'-D(*CP*TP*AP*AP*CP*GP*GP*AP*AP*TP*G)-3'), ~{N}-(7-methyl-1,8-naphthyridin-2-yl)-3-[[3-[(7-methyl-1,8-naphthyridin-2-yl)amino]-3-oxidanylidene-propyl]amino]propanamide
著者Sakurabayashi, S, Furuita, K, Yamada, T, Nomura, M, Nakatani, K, Kojima, C.
登録日2024-05-01
公開日2025-04-30
実験手法SOLUTION NMR
主引用文献NMR structure of the (CGG-dsDNA:ND=) 1:2 complex
To Be Published
2VGB
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BU of 2vgb by Molmil
HUMAN ERYTHROCYTE PYRUVATE KINASE
分子名称: 1,6-di-O-phosphono-beta-D-fructofuranose, 2-PHOSPHOGLYCOLIC ACID, MANGANESE (II) ION, ...
著者Valentini, G, Chiarelli, L, Fortin, R, Dolzan, M, Galizzi, A, Abraham, D.J, Wang, C, Bianchi, P, Zanella, A, Mattevi, A.
登録日2007-11-12
公開日2007-11-20
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (2.73 Å)
主引用文献Structure and Function of Human Erythrocyte Pyruvate Kinase. Molecular Basis of Nonspherocytic Hemolytic Anemia.
J.Biol.Chem., 277, 2002
7EVJ
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BU of 7evj by Molmil
Crystal structure of CBP bromodomain liganded with 9c
分子名称: 3-acetyl-1-((3-(1-cyclopropyl-1H-pyrazol-4-yl)-2-fluoro-5-(hydroxymethyl)phenyl)carbamoyl)indolizin-7-yl dimethylcarbamate, CREB-binding protein, GLYCEROL, ...
著者Xiang, Q, Wang, C, Wu, T, Zhang, Y, Zhang, C, Luo, G, Wu, X, Shen, H, Xu, Y.
登録日2021-05-21
公開日2022-02-16
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.57 Å)
主引用文献Design, Synthesis, and Biological Evaluation of 1-(Indolizin-3-yl)ethan-1-ones as CBP Bromodomain Inhibitors for the Treatment of Prostate Cancer.
J.Med.Chem., 65, 2022
7FIO
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BU of 7fio by Molmil
LecA from Pseudomonas aeruginosa in complex with a synthetic monovalent galactosidic inhibitor
分子名称: 1,2-ETHANEDIOL, CALCIUM ION, N-[2-[4-[(2S)-3-(2-hydroxyethylamino)-3-oxidanylidene-2-(2-phenoxyethanoylamino)propyl]-1,2,3-triazol-1-yl]ethyl]-4-[(2S,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]sulfanyl-benzamide, ...
著者Kuhaudomlarp, S, Siebs, E, da Silva Figueiredo Celestino Gomes, P, Fortin, C, Rognan, D, Rademacher, C, Imberty, A, Titz, A.
登録日2021-07-31
公開日2022-02-16
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Targeting the Central Pocket of the Pseudomonas aeruginosa Lectin LecA.
Chembiochem, 23, 2022
8ZMP
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BU of 8zmp by Molmil
Cryo-EM structure of the spike glycoprotein from Bat SARS-like coronavirus (Bat SL-CoV) WIV1 in locked state
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, LINOLEIC ACID, ...
著者Liu, C, Beck, F, Nagy, I, Bohn, S, Plitzko, J, Baumeister, W, Zhang, X, Zinzula, L.
登録日2024-05-23
公開日2025-05-28
実験手法ELECTRON MICROSCOPY (3.38 Å)
主引用文献Cryo-EM structure of the spike glycoprotein from Bat SARS-like coronavirus WIV1
To Be Published
4U7D
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BU of 4u7d by Molmil
Structure of human RECQ-like helicase in complex with an oligonucleotide
分子名称: ATP-dependent DNA helicase Q1, DNA oligonucleotide, ZINC ION
著者Pike, A.C.W, Zhang, Y, Schnecke, C, Cooper, C.D.O, von Delft, F, Arrowsmith, C.H, Edwards, A, Bountra, C, Gileadi, O, Structural Genomics Consortium (SGC)
登録日2014-07-30
公開日2015-01-21
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (3.4 Å)
主引用文献Human RECQ1 helicase-driven DNA unwinding, annealing, and branch migration: Insights from DNA complex structures.
Proc.Natl.Acad.Sci.USA, 112, 2015
8ZW0
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BU of 8zw0 by Molmil
Cryo-EM strcuture of Prostaglandin D2 Receptor DP1 activated by PGD2
分子名称: CHOLESTEROL, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1, ...
著者Xu, J, Xu, Y, Wu, C, Xu, H.E.
登録日2024-06-12
公開日2025-05-28
最終更新日2025-06-25
実験手法ELECTRON MICROSCOPY (2.72 Å)
主引用文献Molecular basis for ligand recognition and receptor activation of the prostaglandin D2 receptor DP1.
Proc.Natl.Acad.Sci.USA, 122, 2025
8ZST
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BU of 8zst by Molmil
Lysozyme Crystallized with Bioassembler on Earth
分子名称: 10-((2R)-2-HYDROXYPROPYL)-1,4,7,10-TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID, CHLORIDE ION, GADOLINIUM ATOM, ...
著者MacCarthy, C, Koudan, E.V, Petrov, S.V, Levin, A.A, Khesuani, Y.D, Borshchevskiy, V.
登録日2024-06-05
公開日2025-05-28
最終更新日2025-06-25
実験手法X-RAY DIFFRACTION (0.8 Å)
主引用文献Exploring the potential of a bioassembler for protein crystallization in space.
Npj Microgravity, 11, 2025
8ZVZ
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BU of 8zvz by Molmil
Cryo-EM strcuture of Prostaglandin D2 Receptor DP1 activated by BW245C
分子名称: 7-{(4S)-3-[(3R)-3-cyclohexyl-3-hydroxypropyl]-2,5-dioxoimidazolidin-4-yl}heptanoic acid, CHOLESTEROL, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, ...
著者Xu, J, Xu, Y, Wu, C, Xu, H.E.
登録日2024-06-12
公開日2025-05-28
最終更新日2025-06-25
実験手法ELECTRON MICROSCOPY (2.35 Å)
主引用文献Molecular basis for ligand recognition and receptor activation of the prostaglandin D2 receptor DP1.
Proc.Natl.Acad.Sci.USA, 122, 2025
8ZSU
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BU of 8zsu by Molmil
Lysozyme Crystallized with Bioassembler in Space Microgravity
分子名称: 10-((2R)-2-HYDROXYPROPYL)-1,4,7,10-TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID, CHLORIDE ION, GADOLINIUM ATOM, ...
著者MacCarthy, C, Koudan, E.V, Petrov, S.V, Levin, A.A, Khesuani, Y.D, Borshchevskiy, V.
登録日2024-06-05
公開日2025-05-28
最終更新日2025-06-25
実験手法X-RAY DIFFRACTION (1.09 Å)
主引用文献Exploring the potential of a bioassembler for protein crystallization in space.
Npj Microgravity, 11, 2025
2V22
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BU of 2v22 by Molmil
REPLACE: A strategy for Iterative Design of Cyclin Binding Groove Inhibitors
分子名称: CELL DIVISION PROTEIN KINASE 2, CYCLIN-A2, N~2~-{[1-(4-CHLOROPHENYL)-5-METHYL-1H-1,2,4-TRIAZOL-3-YL]CARBONYL}-N~5~-(DIAMINOMETHYLIDENE)-L-ORNITHYL-L-LEUCYL-L-ISOLEUCYL-4-FLUORO-L-PHENYLALANINAMIDE
著者Andrews, M.J, Kontopidis, G, McInnes, C, Plater, A, Innes, L, Cowan, A, Jewsbury, P, Fischer, P.M.
登録日2007-05-31
公開日2008-01-29
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Replace: A Strategy for Iterative Design of Cyclin- Binding Groove Inhibitors
Chembiochem, 7, 2006

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