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6B8U
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BU of 6b8u by Molmil
Crystals Structure of B-Raf kinase domain in complex with an Imidazopyridinyl benzamide inhibitor
分子名称: Serine/threonine-protein kinase B-raf, ~{N}-[3-(2-acetamidoimidazo[1,2-a]pyridin-6-yl)-4-methyl-phenyl]-3-(trifluoromethyl)benzamide
著者Appleton, B.A, Murray, J, Shafer, C.M.
登録日2017-10-09
公開日2017-11-22
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.68 Å)
主引用文献Imidazo[1,2-a]pyridin-6-yl-benzamide analogs as potent RAF inhibitors.
Bioorg. Med. Chem. Lett., 27, 2017
6KAF
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C2S2M2N2-type PSII-LHCII
分子名称: (1R,3R)-6-{(3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1S,4R,6R)-4-HYDROXY-2,2,6-TRIMETHYL-7-OXABICYCLO[4.1.0]HEPT-1-YL]-3,7,12,16-TETRAMETHYLOCTADECA-1,3,5,7,9,11,13,15,17-NONAENYLIDENE}-1,5,5-TRIMETHYLCYCLOHEXANE-1,3-DIOL, (3R,3'R,6S)-4,5-DIDEHYDRO-5,6-DIHYDRO-BETA,BETA-CAROTENE-3,3'-DIOL, (3S,5R,6S,3'S,5'R,6'S)-5,6,5',6'-DIEPOXY-5,6,5',6'- TETRAHYDRO-BETA,BETA-CAROTENE-3,3'-DIOL, ...
著者Chang, S.H, Shen, L.L, Huang, Z.H, Wang, W.D, Han, G.Y, Shen, J.R, Zhang, X.
登録日2019-06-22
公開日2019-10-23
最終更新日2025-04-09
実験手法ELECTRON MICROSCOPY (3.73 Å)
主引用文献Structure of a C2S2M2N2-type PSII-LHCII supercomplex from the green algaChlamydomonas reinhardtii.
Proc.Natl.Acad.Sci.USA, 116, 2019
4J99
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BU of 4j99 by Molmil
Crystal Structure of FGF Receptor 2 (FGFR2) Kinase Domain Harboring the Gain-of-Function K659T Mutation.
分子名称: Fibroblast growth factor receptor 2, MAGNESIUM ION, PHOSPHOMETHYLPHOSPHONIC ACID ADENYLATE ESTER, ...
著者Chen, H, Mohammadi, M.
登録日2013-02-15
公開日2013-08-07
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.8474 Å)
主引用文献Cracking the Molecular Origin of Intrinsic Tyrosine Kinase Activity through Analysis of Pathogenic Gain-of-Function Mutations.
Cell Rep, 4, 2013
4J96
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BU of 4j96 by Molmil
Crystal Structure of FGF Receptor 2 (FGFR2) Kinase Domain Harboring the Pathogenic Gain-of-Function K659M Mutation Identified in Cervical Cancer.
分子名称: CITRATE ANION, Fibroblast growth factor receptor 2, MAGNESIUM ION, ...
著者Chen, H, Mohammadi, M.
登録日2013-02-15
公開日2013-08-07
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.2972 Å)
主引用文献Cracking the Molecular Origin of Intrinsic Tyrosine Kinase Activity through Analysis of Pathogenic Gain-of-Function Mutations.
Cell Rep, 4, 2013
8V52
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BU of 8v52 by Molmil
Crystal structure of 2A10 Fab bound to Human TGF-beta3
分子名称: 2A10 Fab Heavy Chain, 2A10 Fab Light chain, Transforming growth factor beta-3
著者Yin, J, Lupardus, P.J.
登録日2023-11-30
公開日2024-04-10
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Isoform-selective TGF-beta 3 inhibition for systemic sclerosis.
Med, 5, 2024
9JLM
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BU of 9jlm by Molmil
Crystal structure of aldolase AtoB 1.9A
分子名称: AtoB aldolase, CALCIUM ION
著者Ma, K, Fan, A, Lin, W.
登録日2024-09-19
公開日2025-03-12
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Three-dimensional structural alignment based discovery and molecular basis of AtoB, catalyzing linear tetracyclic formation.
Chem Sci, 15, 2024
9IR5
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BU of 9ir5 by Molmil
Crystal structure of apo-form UDP-N-acetylmuramic Acid L-alanine ligase (MurC) from Roseburia faecis
分子名称: 1,2-ETHANEDIOL, UDP-N-acetylmuramate--L-alanine ligase
著者Wang, Y.X, Du, Y.H.
登録日2024-07-14
公開日2025-04-09
最終更新日2025-06-11
実験手法X-RAY DIFFRACTION (2.36 Å)
主引用文献Unusual MurC Ligase and Peptidoglycan Discovered in Lachnospiraceae Using a Fluorescent L-Amino Acid Based Selective Labeling Probe.
Angew.Chem.Int.Ed.Engl., 64, 2025
9IR6
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Crystal structure of UDP-N-acetylmuramic Acid L-alanine ligase (MurC) from Roseburia faecis in complex with UNAM
分子名称: (2R)-2-{[(2R,3R,4R,5S,6R)-3-(acetylamino)-2-{[(S)-{[(R)-{[(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}-5-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl]oxy}propanoic acid, 1,2-ETHANEDIOL, UDP-N-acetylmuramate--L-alanine ligase
著者Wang, Y.X, Du, Y.H.
登録日2024-07-14
公開日2025-04-09
最終更新日2025-06-11
実験手法X-RAY DIFFRACTION (2.43 Å)
主引用文献Unusual MurC Ligase and Peptidoglycan Discovered in Lachnospiraceae Using a Fluorescent L-Amino Acid Based Selective Labeling Probe.
Angew.Chem.Int.Ed.Engl., 64, 2025
9J7N
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BU of 9j7n by Molmil
Cryo-EM structure of TauT
分子名称: BETA-ALANINE, CHLORIDE ION, CHOLESTEROL, ...
著者Zhao, Y, Xu, H.
登録日2024-08-19
公開日2025-04-02
最終更新日2025-07-02
実験手法ELECTRON MICROSCOPY (3.14 Å)
主引用文献Structural characterization reveals substrate recognition by the taurine transporter TauT.
Cell Discov, 11, 2025
9J7M
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Cryo-EM structure of TauT
分子名称: 2-AMINOETHANESULFONIC ACID, CHLORIDE ION, CHOLESTEROL, ...
著者Zhao, Y, Xu, H.
登録日2024-08-19
公開日2025-04-02
最終更新日2025-05-14
実験手法ELECTRON MICROSCOPY (2.82 Å)
主引用文献Structural characterization reveals substrate recognition by the taurine transporter TauT.
Cell Discov, 11, 2025
9J7O
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BU of 9j7o by Molmil
Cryo-EM structure of TauT
分子名称: CHLORIDE ION, CHOLESTEROL, HEXADECANE, ...
著者Zhao, Y, Xu, H.
登録日2024-08-19
公開日2025-04-02
最終更新日2025-05-14
実験手法ELECTRON MICROSCOPY (2.77 Å)
主引用文献Structural characterization reveals substrate recognition by the taurine transporter TauT.
Cell Discov, 11, 2025
9J11
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BU of 9j11 by Molmil
Structure of mEos3.2 in the green fluorescent state
分子名称: 2,3-DIHYDROXY-1,4-DITHIOBUTANE, Green to red photoconvertible GFP-like protein EosFP
著者Zheng, S.P, Shi, X.R.
登録日2024-08-03
公開日2025-04-16
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Structural basis for the fast maturation of pcStar, a photoconvertible fluorescent protein.
Acta Crystallogr D Struct Biol, 81, 2025
9J0R
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BU of 9j0r by Molmil
Structure of pcStar in the green fluorescent state
分子名称: 2,3-DIHYDROXY-1,4-DITHIOBUTANE, Green to red photoconvertible GFP-like protein EosFP
著者Zheng, S.P, Shi, X.R.
登録日2024-08-02
公開日2025-04-16
実験手法X-RAY DIFFRACTION (1.66 Å)
主引用文献Structural basis for the fast maturation of pcStar, a photoconvertible fluorescent protein.
Acta Crystallogr D Struct Biol, 81, 2025
9J0Q
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BU of 9j0q by Molmil
Structure of mEos3.2 in the green fluorescent state
分子名称: Green to red photoconvertible GFP-like protein EosFP, SULFATE ION
著者Zheng, S.P, Shi, X.R.
登録日2024-08-02
公開日2025-04-16
実験手法X-RAY DIFFRACTION (1.34 Å)
主引用文献Structural basis for the fast maturation of pcStar, a photoconvertible fluorescent protein.
Acta Crystallogr D Struct Biol, 81, 2025
7CH1
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BU of 7ch1 by Molmil
The overall structure of SLC26A9
分子名称: CHLORIDE ION, SODIUM ION, Solute carrier family 26 member 9
著者Chi, X.M, Chen, Y, Li, X.R, Zhang, Y.Y, Zhou, Q.
登録日2020-07-03
公開日2020-08-26
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (2.6 Å)
主引用文献Structural insights into the gating mechanism of human SLC26A9 mediated by its C-terminal sequence.
Cell Discov, 6, 2020
8WMA
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BU of 8wma by Molmil
Fzd4/DEP complex (local refined)
分子名称: Frizzled-4, Segment polarity protein dishevelled homolog DVL-2
著者He, Y, Qian, Y.
登録日2023-10-03
公開日2024-09-11
最終更新日2024-10-30
実験手法ELECTRON MICROSCOPY (3.47 Å)
主引用文献Structural basis of Frizzled 4 in recognition of Dishevelled 2 unveils mechanism of WNT signaling activation.
Nat Commun, 15, 2024
8WM9
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Fzd4/DEP complex
分子名称: CHOLESTEROL HEMISUCCINATE, Frizzled-4, Segment polarity protein dishevelled homolog DVL-2
著者He, Y, Qian, Y.
登録日2023-10-03
公開日2024-09-11
最終更新日2024-11-13
実験手法ELECTRON MICROSCOPY (3.53 Å)
主引用文献Structural basis of Frizzled 4 in recognition of Dishevelled 2 unveils mechanism of WNT signaling activation.
Nat Commun, 15, 2024
7WVP
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BU of 7wvp by Molmil
Cryo-EM structure of SARS-CoV-2 Omicron Spike protein with human ACE2 receptor, C2 state
分子名称: Angiotensin-converting enzyme 2, Spike glycoprotein
著者Han, W.Y, Wang, Y.F.
登録日2022-02-10
公開日2022-04-06
最終更新日2024-11-13
実験手法ELECTRON MICROSCOPY (3.7 Å)
主引用文献Molecular basis of receptor binding and antibody neutralization of Omicron.
Nature, 604, 2022
7WVQ
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Cryo-EM structure of SARS-CoV-2 Omicron Spike protein with human ACE2 receptor, C3 state
分子名称: Angiotensin-converting enzyme 2, Spike glycoprotein
著者Han, W.Y, Wang, Y.F.
登録日2022-02-10
公開日2022-04-06
最終更新日2025-07-02
実験手法ELECTRON MICROSCOPY (4.04 Å)
主引用文献Molecular basis of receptor binding and antibody neutralization of Omicron.
Nature, 604, 2022
8K9X
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Crystal structure of plasmodium LysRS complexing with ASP3026 derived LysRS inhibitor 5 (ADKI5)
分子名称: (2~{S})-2,6-bis(azanyl)-~{N}-[3-[2-[[4-[(2,5-dimethoxyphenyl)amino]-1,3,5-triazin-2-yl]amino]phenyl]sulfonylpropyl]hexanamide, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Lysine--tRNA ligase
著者Zhou, J, Xia, M, Yang, G, Li, P, Fang, P.
登録日2023-08-01
公開日2024-06-26
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Structure-guided conversion from an anaplastic lymphoma kinase inhibitor into Plasmodium lysyl-tRNA synthetase selective inhibitors.
Commun Biol, 7, 2024
8K9V
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Crystal structure of plasmodium LysRS complexing with ASP3026 derived LysRS inhibitor 3 (ADKI3)
分子名称: GLYCEROL, LYSINE, Lysine--tRNA ligase, ...
著者Zhou, J, Xia, M, Yang, G, Li, P, Fang, P.
登録日2023-08-01
公開日2024-06-26
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (1.92 Å)
主引用文献Structure-guided conversion from an anaplastic lymphoma kinase inhibitor into Plasmodium lysyl-tRNA synthetase selective inhibitors.
Commun Biol, 7, 2024
8K9S
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Crystal structure of plasmodium LysRS complexing with ASP3026 derived LysRS inhibitor 1 (ADKI1)
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, LYSINE, Lysine--tRNA ligase, ...
著者Zhou, J, Xia, M, Yang, G, Li, P, Fang, P.
登録日2023-08-01
公開日2024-06-26
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Structure-guided conversion from an anaplastic lymphoma kinase inhibitor into Plasmodium lysyl-tRNA synthetase selective inhibitors.
Commun Biol, 7, 2024
8K9W
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Crystal structure of plasmodium LysRS complexing with ASP3026 derived LysRS inhibitor 4 (ADKI4)
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Lysine--tRNA ligase, ~{N}2-(2-methoxyphenyl)-~{N}4-(2-propan-2-ylsulfonylphenyl)-1,3,5-triazine-2,4-diamine
著者Zhou, J, Xia, M, Yang, G, Li, P, Fang, P.
登録日2023-08-01
公開日2024-06-26
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structure-guided conversion from an anaplastic lymphoma kinase inhibitor into Plasmodium lysyl-tRNA synthetase selective inhibitors.
Commun Biol, 7, 2024
8K9U
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BU of 8k9u by Molmil
Crystal structure of plasmodium LysRS complexing with ASP3026 derived LysRS inhibitor 2 (ADKI2)
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, LYSINE, Lysine--tRNA ligase, ...
著者Zhou, J, Xia, M, Yang, G, Li, P, Fang, P.
登録日2023-08-01
公開日2024-06-26
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (2.83 Å)
主引用文献Structure-guided conversion from an anaplastic lymphoma kinase inhibitor into Plasmodium lysyl-tRNA synthetase selective inhibitors.
Commun Biol, 7, 2024
7XM9
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Cryo-EM structure of human NaV1.7/beta1/beta2-XEN907
分子名称: (7~{R})-1'-pentylspiro[6~{H}-furo[3,2-f][1,3]benzodioxole-7,3'-indole]-2'-one, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者zhang, J.T, Jiang, D.H.
登録日2022-04-25
公開日2022-11-30
最終更新日2025-06-18
実験手法ELECTRON MICROSCOPY (3.22 Å)
主引用文献Structural basis for Na V 1.7 inhibition by pore blockers.
Nat.Struct.Mol.Biol., 29, 2022

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