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8XS5
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Cryo-EM structure of OSCA1.2-DOPC-1:20-contracted2 state
分子名称: Calcium permeable stress-gated cation channel 1
著者Zhang, Y, Han, Y.
登録日2024-01-08
公開日2024-04-10
最終更新日2025-07-02
実験手法ELECTRON MICROSCOPY (3.33 Å)
主引用文献Mechanical activation opens a lipid-lined pore in OSCA ion channels.
Nature, 628, 2024
2VUO
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Crystal structure of the rabbit IgG Fc fragment
分子名称: AZIDE ION, FORMIC ACID, GLYCEROL, ...
著者Girardi, E, Holdom, M.D, Davies, A.M, Sutton, B.J, Beavil, A.J.
登録日2008-05-27
公開日2008-09-16
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献The Crystal Structure of Rabbit Igg-Fc.
Biochem.J., 417, 2009
6I25
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BU of 6i25 by Molmil
Flavin Analogue Sheds Light on Light-Oxygen-Voltage Domain Mechanism
分子名称: 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydropyrimido[4,5-b]quinolin-10(2H)-yl)-5-O-phosphono-D-ribitol, Aureochrome1-like protein, CHLORIDE ION, ...
著者Rizkallah, P.J, Kalvaitis, M.E.
登録日2018-10-31
公開日2019-06-19
最終更新日2024-10-09
実験手法X-RAY DIFFRACTION (1.97 Å)
主引用文献A Noncanonical Chromophore Reveals Structural Rearrangements of the Light-Oxygen-Voltage Domain upon Photoactivation.
Biochemistry, 58, 2019
7XGD
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Cryo-EM structure of Apo-IGF1R map 1
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Insulin-like growth factor 1 receptor
著者Zhang, X, Wu, C.
登録日2022-04-04
公開日2023-04-12
最終更新日2024-10-09
実験手法ELECTRON MICROSCOPY (4 Å)
主引用文献Cryo-EM structure of Apo-IGF1R
To Be Published
5F9S
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BU of 5f9s by Molmil
Crystal structure of human Alanine:Glyoxylate Aminotransferase major allele (AGT-Ma) at 1.7 Angstrom; internal aldimine with PLP in the active site
分子名称: PYRIDOXAL-5'-PHOSPHATE, Serine--pyruvate aminotransferase
著者Giardina, G, Cutruzzola, F, Borri Voltattorni, C, Cellini, B, Montioli, R.
登録日2015-12-10
公開日2016-12-21
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Radiation damage at the active site of human alanine:glyoxylate aminotransferase reveals that the cofactor position is finely tuned during catalysis.
Sci Rep, 7, 2017
4OJJ
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BU of 4ojj by Molmil
Structure of C-terminal domain from S. cerevisiae Pat1 decapping activator (Space group : P212121)
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, DNA topoisomerase 2-associated protein PAT1, ...
著者Fourati-Kammoun, Z, Kolesnikova, O, Back, R, Keller, J, Lazar, N, Gaudon-Plesse, C, Seraphin, B, Graille, M.
登録日2014-01-21
公開日2014-10-08
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.32 Å)
主引用文献The C-terminal domain from S. cerevisiae Pat1 displays two conserved regions involved in decapping factor recruitment.
Plos One, 9, 2014
5JF2
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BU of 5jf2 by Molmil
Crystal structure of type 2 PDF from Streptococcus agalactiae in complex with inhibitor AT002
分子名称: (3R)-3-{3-[(4-fluorophenyl)methyl]-1,2,4-oxadiazol-5-yl}-N-hydroxyheptanamide, ACETATE ION, IMIDAZOLE, ...
著者Fieulaine, S, Giglione, C, Meinnel, T, Hamiche, K.
登録日2016-04-19
公開日2016-11-30
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献A unique peptide deformylase platform to rationally design and challenge novel active compounds.
Sci Rep, 6, 2016
1AXS
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MATURE OXY-COPE CATALYTIC ANTIBODY WITH HAPTEN
分子名称: (1S,2S,5S)2-(4-GLUTARIDYLBENZYL)-5-PHENYL-1-CYCLOHEXANOL, CADMIUM ION, OXY-COPE CATALYTIC ANTIBODY
著者Mundorff, E.C, Ulrich, H.D, Stevens, R.C.
登録日1997-10-20
公開日1998-02-04
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献The interplay between binding energy and catalysis in the evolution of a catalytic antibody.
Nature, 389, 1997
3NFY
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BU of 3nfy by Molmil
The Structure of Human Bisphosphoglycerate Mutase to 1.94A
分子名称: Bisphosphoglycerate mutase
著者Patterson, A.F, Price, N.C, Nairn, J.
登録日2010-06-10
公開日2010-11-10
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.94 Å)
主引用文献Unliganded structure of human bisphosphoglycerate mutase reveals side-chain movements induced by ligand binding.
Acta Crystallogr.,Sect.F, 66, 2010
6E4A
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BU of 6e4a by Molmil
Crystal structure of human BRD4(1) in complex with CN750
分子名称: 5-(4-{[(3-chlorophenyl)methyl]amino}-2-{4-[2-(dimethylamino)ethyl]piperazin-1-yl}quinazolin-6-yl)-1-methylpyridin-2(1H)-one, Bromodomain-containing protein 4, GLYCEROL
著者Fontano, E, White, A, Lakshminarasimhan, D, Suto, R.K.
登録日2018-07-17
公開日2018-09-12
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.26 Å)
主引用文献Discovery and lead identification of quinazoline-based BRD4 inhibitors.
Bioorg. Med. Chem. Lett., 28, 2018
7B30
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MST3 in complex with compound G-5555
分子名称: 8-[(trans-5-amino-1,3-dioxan-2-yl)methyl]-6-[2-chloro-4-(6-methylpyridin-2-yl)phenyl]-2-(methylamino)pyrido[2,3-d]pyrimidin-7(8H)-one, Serine/threonine-protein kinase 24
著者Tesch, R, Rak, M, Joerger, A.C, Knapp, S, Structural Genomics Consortium (SGC)
登録日2020-11-28
公開日2020-12-16
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structure-Based Design of Selective Salt-Inducible Kinase Inhibitors.
J.Med.Chem., 64, 2021
6E48
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Crystal Structure of the Murine Norovirus VP1 P domain in complex with the CD300lf Receptor and Lithocholic Acid
分子名称: (3beta,5beta,14beta,17alpha)-3-hydroxycholan-24-oic acid, 1,2-ETHANEDIOL, CALCIUM ION, ...
著者Nelson, C.A, Fremont, D.H.
登録日2018-07-16
公開日2018-09-12
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (1.801 Å)
主引用文献Structural basis for murine norovirus engagement of bile acids and the CD300lf receptor.
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
9GWD
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BU of 9gwd by Molmil
ZT-KP6-1: AN EFFECTOR FROM ZYMOSEPTORIA TRITICI
分子名称: Zt-KP6-1
著者Barthe, P, de Guillen, K.
登録日2024-09-26
公開日2024-10-09
最終更新日2025-09-17
実験手法SOLUTION NMR
主引用文献Zymoseptoria tritici Effectors Structurally Related to Killer Proteins UmV-KP4 and UmV-KP6 Inhibit Fungal Growth, and Define Extended Protein Families in Fungi.
Mol Plant Pathol, 26, 2025
8Y2H
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BU of 8y2h by Molmil
GK tetramer of AtP5CS1 filament with adjacent hooks, reaction state
分子名称: ADENOSINE-5'-TRIPHOSPHATE, Delta-1-pyrroline-5-carboxylate synthase A
著者Zhang, T, Guo, C.J, Liu, J.L.
登録日2024-01-26
公開日2024-06-05
最終更新日2024-07-10
実験手法ELECTRON MICROSCOPY (3.3 Å)
主引用文献Dynamic Arabidopsis P5CS filament facilitates substrate channelling.
Nat.Plants, 10, 2024
6RWQ
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BU of 6rwq by Molmil
Engineered beta-lactoglobulin: variant F105L in complex with myristic acid
分子名称: 1,2-ETHANEDIOL, Beta-lactoglobulin, MYRISTIC ACID
著者Loch, J.I, Gotkowski, M, Lewinski, K.
登録日2019-06-05
公開日2019-06-19
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Structure-based design approach to rational site-directed mutagenesis of beta-lactoglobulin.
J.Struct.Biol., 210, 2020
6C19
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BU of 6c19 by Molmil
FGFR1 kinase complex with inhibitor SN36985
分子名称: 3-(2,6-dichloro-3,5-dimethoxyphenyl)-1-{(3S)-1-[(2E)-4-(dimethylamino)but-2-enoyl]pyrrolidin-3-yl}-7-(methylamino)-3,4-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one, Fibroblast growth factor receptor 1, SULFATE ION
著者Yosaatmadja, Y, Smaill, J.B, Squire, C.J.
登録日2018-01-04
公開日2019-01-16
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.12 Å)
主引用文献Understanding the structural requirements for covalent inhibition of FGFR1-3
To Be Published
1B8F
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BU of 1b8f by Molmil
Histidine ammonia-lyase (HAL) from Pseudomonas putida
分子名称: GLYCEROL, Histidine ammonia-lyase, SULFATE ION
著者Schwede, T.F, Schulz, G.E.
登録日1999-01-31
公開日1999-05-06
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Crystal structure of histidine ammonia-lyase revealing a novel polypeptide modification as the catalytic electrophile.
Biochemistry, 38, 1999
4OVV
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BU of 4ovv by Molmil
Crystal Structure of PI3Kalpha in complex with diC4-PIP2
分子名称: (2R)-3-{[(R)-HYDROXY{[(1R,2R,3S,4R,5R,6S)-2,3,6-TRIHYDROXY-4,5-BIS(PHOSPHONOOXY)CYCLOHEXYL]OXY}PHOSPHORYL]OXY}PROPANE-1 ,2-DIYL DIBUTANOATE, PHOSPHATE ION, Phosphatidylinositol 3-kinase regulatory subunit alpha, ...
著者Gabelli, S.B, Vogelstein, B, Miller, M, Amzel, L.M.
登録日2014-01-14
公開日2014-09-03
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (3.5 Å)
主引用文献Structural basis of nSH2 regulation and lipid binding in PI3K alpha.
Oncotarget, 5, 2014
6THW
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BU of 6thw by Molmil
IRAK4 in complex with inhibitor
分子名称: 7-fluoranyl-4-(1-methylcyclopropyl)oxy-~{N}-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-6-(2-methylpyrimidin-5-yl)pyrido[3,2-d]pyrimidin-2-amine, Interleukin-1 receptor-associated kinase 4
著者Xue, Y, Aagaard, A, Degorce, S.L.
登録日2019-11-21
公開日2020-10-28
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (2.44 Å)
主引用文献Improving metabolic stability and removing aldehyde oxidase liability in a 5-azaquinazoline series of IRAK4 inhibitors.
Bioorg.Med.Chem., 28, 2020
6C1W
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A tethered niacin-derived pincer complex with a nickel-carbon or sulfite-carbon bond in lactate racemase
分子名称: (4S)-5-methanethioyl-1-(5-O-phosphono-beta-D-ribofuranosyl)-4-sulfo-1,4-dihydropyridine-3-carbothioic S-acid, 3-methanethioyl-1-(5-O-phosphono-beta-D-ribofuranosyl)-5-(sulfanylcarbonyl)pyridin-1-ium, Lactate racemase, ...
著者Fellner, M, Desguin, B, Hausinger, R.P, Hu, J.
登録日2018-01-05
公開日2018-03-14
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (2.398 Å)
主引用文献Lactate Racemase Nickel-Pincer Cofactor Operates by a Proton-Coupled Hydride Transfer Mechanism.
Biochemistry, 57, 2018
7YKR
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BU of 7ykr by Molmil
Structure of TRPA1 in Drosophila melanogaster in a state with 17 ankyrin repeats determined
分子名称: Transient receptor potential cation channel subfamily A member 1
著者Sun, L, Liu, X, Yang, Z, Wang, X.
登録日2022-07-23
公開日2023-07-26
最終更新日2024-11-13
実験手法ELECTRON MICROSCOPY (3.2 Å)
主引用文献Molecular architecture and gating mechanisms of the Drosophila TRPA1 channel.
Cell Discov, 9, 2023
6INM
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Crystal structure of PDE4D complexed with a novel inhibitor
分子名称: (1S)-1-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbaldehyde, 1,2-ETHANEDIOL, MAGNESIUM ION, ...
著者Zhang, X.L, Su, H.X, Xu, Y.C.
登録日2018-10-26
公開日2019-10-23
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (1.999 Å)
主引用文献Structure-Aided Identification and Optimization of Tetrahydro-isoquinolines as Novel PDE4 Inhibitors Leading to Discovery of an Effective Antipsoriasis Agent.
J.Med.Chem., 62, 2019
9H28
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Alternative conformation LGTV with TBEV prME
分子名称: 1-PALMITOYL-2-LINOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Envelope protein E, ...
著者Bisikalo, K, Rosendal, E.
登録日2024-10-11
公開日2024-11-06
最終更新日2025-10-08
実験手法ELECTRON MICROSCOPY (3.22 Å)
主引用文献Influence of the pre-membrane and envelope proteins on structure, pathogenicity, and tropism of tick-borne encephalitis virus.
J.Virol., 99, 2025
6TNZ
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BU of 6tnz by Molmil
Human polymerase delta-FEN1-PCNA toolbelt
分子名称: DNA polymerase delta catalytic subunit, DNA polymerase delta subunit 2, DNA polymerase delta subunit 3, ...
著者Lancey, C, Hamdan, S.M, De Biasio, A.
登録日2019-12-10
公開日2019-12-18
最終更新日2024-05-22
実験手法ELECTRON MICROSCOPY (4.05 Å)
主引用文献Structure of the processive human Pol delta holoenzyme.
Nat Commun, 11, 2020
7YMU
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Structure of Alcohol dehydrogenase from [Candida] glabrata
分子名称: 1,2-ETHANEDIOL, CITRIC ACID, DI(HYDROXYETHYL)ETHER, ...
著者Sun, Z.W, Liu, Y.F, Xu, G.C, Ni, Y.
登録日2022-07-29
公開日2023-08-02
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Rationla design of CgADH from candida glarata for asymmetric reduction of azacycolne.
To Be Published

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