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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
Descriptor: Beta-2-microglobulin, MAGE-A4 peptide (amino acids 230-239), MHC class I antigen, ...
Authors:Coles, C.H, McMurran, C, Lloyd, A, Hibbert, L, Lupardus, P.J, Cole, D.K, Harper, S.
Deposit date:2019-12-19
Release date:2020-06-24
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (3 Å)
Cite: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+
Descriptor: Anoctamin-6, CALCIUM ION
Authors:Arndt, M, Alvadia, C, Straub, M.S, Clerico-Mosina, V, Paulino, C, Dutzler, R.
Deposit date:2022-10-04
Release date:2022-12-21
Last modified:2024-11-13
Method:ELECTRON MICROSCOPY (2.94 Å)
Cite: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
Descriptor: 2'-deoxy-2'-fluoroadenosine 5'-(dihydrogen phosphate), CRISPR system endoribonuclease Csm6, SULFATE ION
Authors:Garcia-Doval, C, Jinek, M.
Deposit date:2020-01-07
Release date:2020-02-26
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (2.42 Å)
Cite: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
Descriptor: CDK-activating kinase assembly factor MAT1, CHLORIDE ION, General transcription and DNA repair factor IIH helicase subunit XPD
Authors:Sauer, F, Kisker, C.
Deposit date:2020-01-07
Release date:2020-11-11
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (2.07 Å)
Cite: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
Descriptor: 1,2-ETHANEDIOL, Beta-2-microglobulin, MAGE-A4 peptide (amino acids 230-239) variant, ...
Authors:Coles, C.H, McMurran, C, Lloyd, A, Hibbert, L, Lupardus, P.J, Cole, D.K, Harper, S.
Deposit date:2019-12-19
Release date:2020-06-24
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.35 Å)
Cite: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)
Descriptor: GLYCEROL, Glutamate--tRNA ligase, SULFATE ION
Authors:Benas, P, Jaramillo Ponce, J.R, Frugier, M, Sauter, C.
Deposit date:2022-10-17
Release date:2023-01-25
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.7 Å)
Cite: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
Descriptor: ROUNDABOUT HOMOLOG 1, SLIT HOMOLOG 2 PROTEIN N-PRODUCT
Authors:Morlot, C, Cusack, S, McCarthy, A.A.
Deposit date:2007-08-25
Release date:2007-09-25
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (1.7 Å)
Cite: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
Descriptor: Adr-2-binding protein 1, Double-stranded RNA-specific adenosine deaminase adr-2, INOSITOL HEXAKISPHOSPHATE, ...
Authors:Liu, Z.M, Mu, J.Q, Wu, C.
Deposit date:2024-05-06
Release date:2025-05-14
Method:ELECTRON MICROSCOPY (2.99 Å)
Cite: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
Descriptor: AZITHROMYCIN, CHOLESTEROL, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, ...
Authors:Xu, H.E, You, C, Jiang, Y.
Deposit date:2024-09-20
Release date:2025-05-28
Last modified:2025-06-25
Method:ELECTRON MICROSCOPY (2.74 Å)
Cite: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
Descriptor: Adr-2-binding protein 1, Double-stranded RNA-specific adenosine deaminase adr-2, INOSITOL HEXAKISPHOSPHATE, ...
Authors:Liu, Z.M, Mu, J.Q, Wu, C.
Deposit date:2024-05-06
Release date:2025-05-14
Method:ELECTRON MICROSCOPY (3.29 Å)
Cite: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
Descriptor: Adr-2-binding protein 1, Double-stranded RNA-specific adenosine deaminase adr-2, INOSITOL HEXAKISPHOSPHATE, ...
Authors:Liu, Z.M, Mu, J.Q, Wu, C.
Deposit date:2024-05-06
Release date:2025-05-14
Method:ELECTRON MICROSCOPY (2.79 Å)
Cite: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
Descriptor: 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
Authors:Sakurabayashi, S, Furuita, K, Yamada, T, Nomura, M, Nakatani, K, Kojima, C.
Deposit date:2024-05-01
Release date:2025-04-30
Method:SOLUTION NMR
Cite:NMR structure of the (CGG-dsDNA:ND=) 1:1 complex
To Be Published
2VC7
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BU of 2vc7 by Molmil
Structural basis for natural lactonase and promiscuous phosphotriesterase activities
Descriptor: (4S)-4-(decanoylamino)-5-hydroxy-3,4-dihydro-2H-thiophenium, 1,2-ETHANEDIOL, ARYLDIALKYLPHOSPHATASE, ...
Authors:Elias, M, Dupuy, J, Merone, L, Mandrich, L, Moniot, S, Rochu, D, Lecomte, C, Rossi, M, Masson, P, Manco, G, Chabriere, E.
Deposit date:2007-09-19
Release date:2008-04-15
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Structural Basis for Natural Lactonase and Promiscuous Phosphotriesterase Activities.
J.Mol.Biol., 379, 2008
8ZD7
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BU of 8zd7 by Molmil
NMR structure of the CGG-dsDNA-sND complex
Descriptor: 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
Authors:Sakurabayashi, S, Furuita, K, Yamada, T, Nomura, M, Nakatani, K, Kojima, C.
Deposit date:2024-05-01
Release date:2025-04-30
Method:SOLUTION NMR
Cite:NMR structure of the CGG-dsDNA-sND complex
To Be Published
2VGB
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BU of 2vgb by Molmil
HUMAN ERYTHROCYTE PYRUVATE KINASE
Descriptor: 1,6-di-O-phosphono-beta-D-fructofuranose, 2-PHOSPHOGLYCOLIC ACID, MANGANESE (II) ION, ...
Authors:Valentini, G, Chiarelli, L, Fortin, R, Dolzan, M, Galizzi, A, Abraham, D.J, Wang, C, Bianchi, P, Zanella, A, Mattevi, A.
Deposit date:2007-11-12
Release date:2007-11-20
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (2.73 Å)
Cite:Structure and Function of Human Erythrocyte Pyruvate Kinase. Molecular Basis of Nonspherocytic Hemolytic Anemia.
J.Biol.Chem., 277, 2002
8ZD2
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BU of 8zd2 by Molmil
NMR structure of the (CGG-dsDNA:ND=) 1:2 complex
Descriptor: 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
Authors:Sakurabayashi, S, Furuita, K, Yamada, T, Nomura, M, Nakatani, K, Kojima, C.
Deposit date:2024-05-01
Release date:2025-04-30
Method:SOLUTION NMR
Cite:NMR structure of the (CGG-dsDNA:ND=) 1:2 complex
To Be Published
7EVJ
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BU of 7evj by Molmil
Crystal structure of CBP bromodomain liganded with 9c
Descriptor: 3-acetyl-1-((3-(1-cyclopropyl-1H-pyrazol-4-yl)-2-fluoro-5-(hydroxymethyl)phenyl)carbamoyl)indolizin-7-yl dimethylcarbamate, CREB-binding protein, GLYCEROL, ...
Authors:Xiang, Q, Wang, C, Wu, T, Zhang, Y, Zhang, C, Luo, G, Wu, X, Shen, H, Xu, Y.
Deposit date:2021-05-21
Release date:2022-02-16
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.57 Å)
Cite: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
Descriptor: 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, ...
Authors:Kuhaudomlarp, S, Siebs, E, da Silva Figueiredo Celestino Gomes, P, Fortin, C, Rognan, D, Rademacher, C, Imberty, A, Titz, A.
Deposit date:2021-07-31
Release date:2022-02-16
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.5 Å)
Cite: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
Descriptor: 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, ...
Authors:Liu, C, Beck, F, Nagy, I, Bohn, S, Plitzko, J, Baumeister, W, Zhang, X, Zinzula, L.
Deposit date:2024-05-23
Release date:2025-05-28
Method:ELECTRON MICROSCOPY (3.38 Å)
Cite: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
Descriptor: ATP-dependent DNA helicase Q1, DNA oligonucleotide, ZINC ION
Authors: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)
Deposit date:2014-07-30
Release date:2015-01-21
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (3.4 Å)
Cite: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
Descriptor: 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, ...
Authors:Xu, J, Xu, Y, Wu, C, Xu, H.E.
Deposit date:2024-06-12
Release date:2025-05-28
Last modified:2025-06-25
Method:ELECTRON MICROSCOPY (2.72 Å)
Cite: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
Descriptor: 10-((2R)-2-HYDROXYPROPYL)-1,4,7,10-TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID, CHLORIDE ION, GADOLINIUM ATOM, ...
Authors:MacCarthy, C, Koudan, E.V, Petrov, S.V, Levin, A.A, Khesuani, Y.D, Borshchevskiy, V.
Deposit date:2024-06-05
Release date:2025-05-28
Last modified:2025-06-25
Method:X-RAY DIFFRACTION (0.8 Å)
Cite: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
Descriptor: 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, ...
Authors:Xu, J, Xu, Y, Wu, C, Xu, H.E.
Deposit date:2024-06-12
Release date:2025-05-28
Last modified:2025-06-25
Method:ELECTRON MICROSCOPY (2.35 Å)
Cite: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
Descriptor: 10-((2R)-2-HYDROXYPROPYL)-1,4,7,10-TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID, CHLORIDE ION, GADOLINIUM ATOM, ...
Authors:MacCarthy, C, Koudan, E.V, Petrov, S.V, Levin, A.A, Khesuani, Y.D, Borshchevskiy, V.
Deposit date:2024-06-05
Release date:2025-05-28
Last modified:2025-06-25
Method:X-RAY DIFFRACTION (1.09 Å)
Cite: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
Descriptor: 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
Authors:Andrews, M.J, Kontopidis, G, McInnes, C, Plater, A, Innes, L, Cowan, A, Jewsbury, P, Fischer, P.M.
Deposit date:2007-05-31
Release date:2008-01-29
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Replace: A Strategy for Iterative Design of Cyclin- Binding Groove Inhibitors
Chembiochem, 7, 2006

238582

数据于2025-07-09公开中

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