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8TYV
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BU of 8tyv by Molmil
Crystal structure of the SPX domain of XPR1 in complex with IP8
分子名称: (1R,3S,4R,5S,6R)-2,4,5,6-tetrakis(phosphonooxy)cyclohexane-1,3-diyl bis[trihydrogen (diphosphate)], Solute carrier family 53 member 1
著者Wang, H, Shears, S.B.
登録日2023-08-25
公開日2024-06-12
最終更新日2024-12-25
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Homeostatic coordination of cellular phosphate uptake and efflux requires an organelle-based receptor for the inositol pyrophosphate IP8.
Cell Rep, 43, 2024
8TYU
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BU of 8tyu by Molmil
High-resolution crystal structure of the SPX domain of XPR1 at 1.4 angstroms
分子名称: Solute carrier family 53 member 1
著者Wang, H, Shears, S.B.
登録日2023-08-25
公開日2024-06-12
最終更新日2024-12-25
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Homeostatic coordination of cellular phosphate uptake and efflux requires an organelle-based receptor for the inositol pyrophosphate IP8.
Cell Rep, 43, 2024
4QBS
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BU of 4qbs by Molmil
Crystal structure of DNMT3a ADD domain E545R mutant bound to H3T3ph peptide
分子名称: DNA (cytosine-5)-methyltransferase 3A, Histone H3, SULFATE ION, ...
著者Wang, H, Li, H.
登録日2014-05-08
公開日2015-05-13
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Engineering of a histone-recognition domain in a de novo DNA methyltransferase alters the epigenetic landscape of ESCs
To be Published
4QBR
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BU of 4qbr by Molmil
Crystal structure of DNMT3a ADD domain G550D mutant bound to H3 peptide
分子名称: DNA (cytosine-5)-methyltransferase 3A, Histone H3, ZINC ION
著者Wang, H, Li, H.
登録日2014-05-08
公開日2015-05-13
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (1.902 Å)
主引用文献Engineering of a histone-recognition domain in a de novo DNA methyltransferase alters the epigenetic landscape of ESCs
To be Published
5EFW
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BU of 5efw by Molmil
Crystal structure of LOV2-Zdk1 - the complex of oat LOV2 and the affibody protein Zdark1
分子名称: FLAVIN MONONUCLEOTIDE, NPH1-1, SULFATE ION, ...
著者Winkler, A, Wang, H, Hartmann, E, Hahn, K, Schlichting, I.
登録日2015-10-26
公開日2016-07-20
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献LOVTRAP: an optogenetic system for photoinduced protein dissociation.
Nat.Methods, 13, 2016
4I15
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BU of 4i15 by Molmil
Crystal structure of TbrPDEB1
分子名称: Class 1 phosphodiesterase PDEB1, MAGNESIUM ION, ZINC ION
著者Wang, H, Ke, H.
登録日2012-11-20
公開日2013-03-13
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Discovery of Novel Trypanosoma brucei Phosphodiesterase B1 Inhibitors by Virtual Screening against the Unliganded TbrPDEB1 Crystal Structure.
J.Med.Chem., 56, 2013
5F7H
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BU of 5f7h by Molmil
Human T-cell immunoglobulin and mucin domain protein 4 (hTIM-4) complex with phosphoserine
分子名称: CALCIUM ION, PHOSPHOSERINE, T-cell immunoglobulin and mucin domain-containing protein 4
著者Gao, G.F, Lu, G, Wang, H, Qi, J.
登録日2015-12-08
公開日2016-02-03
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Crystal structures of human TIM members: Ebolavirus entry-enhancing receptors
Chin.Sci.Bull., 60, 2015
8H7N
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BU of 8h7n by Molmil
Structure of nanobody 11A in complex with triazophos
分子名称: 1,2-ETHANEDIOL, Nanobody 11A, SODIUM ION, ...
著者Wang, H, Li, J.D, Shen, X, Xu, Z.L, Sun, Y.M.
登録日2022-10-20
公開日2023-10-25
最終更新日2025-04-02
実験手法X-RAY DIFFRACTION (1.99 Å)
主引用文献Structural Insights into the Stability and Recognition Mechanism of the Antiquinalphos Nanobody for the Detection of Quinalphos in Foods.
Anal.Chem., 95, 2023
8H7M
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BU of 8h7m by Molmil
Structure of nanobody 11A in complex with parathion
分子名称: Nanobody 11A, parathion
著者Wang, H, Li, J.D, Shen, X, Xu, Z.L, Sun, Y.M.
登録日2022-10-20
公開日2023-10-25
最終更新日2025-04-02
実験手法X-RAY DIFFRACTION (1.87 Å)
主引用文献Structural Insights into the Stability and Recognition Mechanism of the Antiquinalphos Nanobody for the Detection of Quinalphos in Foods.
Anal.Chem., 95, 2023
8H7I
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BU of 8h7i by Molmil
Structure of nanobody 11A in complex with quinalphos
分子名称: Nanobody 11A, quinalphos
著者Wang, H, Li, J.D, Shen, X, Xu, Z.L, Sun, Y.M.
登録日2022-10-20
公開日2023-10-25
最終更新日2025-04-02
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structural Insights into the Stability and Recognition Mechanism of the Antiquinalphos Nanobody for the Detection of Quinalphos in Foods.
Anal.Chem., 95, 2023
8H7R
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BU of 8h7r by Molmil
Structure of nanobody 11A in complex with coumaphos
分子名称: Nanobody 11A, coumaphos
著者Wang, H, Li, J.D, Shen, X, Xu, Z.L, Sun, Y.M.
登録日2022-10-20
公開日2023-10-25
最終更新日2025-04-02
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structural Insights into the Stability and Recognition Mechanism of the Antiquinalphos Nanobody for the Detection of Quinalphos in Foods.
Anal.Chem., 95, 2023
9BQJ
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BU of 9bqj by Molmil
RO76 bound muOR-Gi1-scFv16 complex structure
分子名称: 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, Guanine nucleotide-binding protein G(i) subunit alpha-1, ...
著者Wang, H, Majumdar, S, Kobilka, B.K.
登録日2024-05-10
公開日2024-09-11
最終更新日2025-05-21
実験手法ELECTRON MICROSCOPY (3.3 Å)
主引用文献Signaling Modulation Mediated by Ligand Water Interactions with the Sodium Site at mu OR.
Acs Cent.Sci., 10, 2024
8Y20
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BU of 8y20 by Molmil
Crystal structure of the Mcl-1 in complex with A-1210477
分子名称: A-1210477, Maltose/maltodextrin-binding periplasmic protein,Induced myeloid leukemia cell differentiation protein Mcl-1, alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose
著者Wang, H, Guo, M, Wei, H, Chen, Y.
登録日2024-01-25
公開日2025-01-29
最終更新日2025-06-25
実験手法X-RAY DIFFRACTION (2.23 Å)
主引用文献Deciphering molecular specificity in MCL-1/BAK interaction and its implications for designing potent MCL-1 inhibitors.
Cell Death Differ., 32, 2025
8Y1Y
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BU of 8y1y by Molmil
Crystal structure of the Mcl-1 in complex with a long BH3 peptide of BAK
分子名称: BH3 peptide from Bcl-2 homologous antagonist/killer, Induced myeloid leukemia cell differentiation protein Mcl-1, ZINC ION
著者Wang, H, Guo, M, Wei, H, Chen, Y.
登録日2024-01-25
公開日2025-01-29
最終更新日2025-06-25
実験手法X-RAY DIFFRACTION (2.01 Å)
主引用文献Deciphering molecular specificity in MCL-1/BAK interaction and its implications for designing potent MCL-1 inhibitors.
Cell Death Differ., 32, 2025
8Y1Z
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BU of 8y1z by Molmil
Crystal structure of the Mcl-1 in complex with a Short BH3 peptide of BAK
分子名称: Induced myeloid leukemia cell differentiation protein Mcl-1, Short BH3 peptide from Bcl-2 homologous antagonist/killer
著者Wang, H, Guo, M, Wei, H, Chen, Y.
登録日2024-01-25
公開日2025-01-29
最終更新日2025-06-25
実験手法X-RAY DIFFRACTION (1.914 Å)
主引用文献Deciphering molecular specificity in MCL-1/BAK interaction and its implications for designing potent MCL-1 inhibitors.
Cell Death Differ., 32, 2025
4IQ8
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BU of 4iq8 by Molmil
Crystal structure of glyceraldehyde-3-phosphate dehydrogenase 3 from Saccharomyces cerevisiae
分子名称: Glyceraldehyde-3-phosphate dehydrogenase 3
著者Wang, H, Liu, Q, Niu, L, Teng, M, Li, X.
登録日2013-01-11
公開日2013-02-06
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.49 Å)
主引用文献Preliminary crystallographic analysis of glyceraldehyde-3-phosphate dehydrogenase 3 from Saccharomyces cerevisiae.
Acta Crystallogr.,Sect.F, 68, 2012
5F7F
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BU of 5f7f by Molmil
Human T-cell immunoglobulin and mucin domain protein 4 (hTIM-4)
分子名称: T-cell immunoglobulin and mucin domain-containing protein 4
著者Gao, G.F, Lu, G, Wang, H, Qi, J.
登録日2015-12-08
公開日2016-02-03
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (1.502 Å)
主引用文献Crystal structures of human TIM members: Ebolavirus entry-enhancing receptors
Chin.Sci.Bull., 60, 2015
5F71
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BU of 5f71 by Molmil
Human T-cell immunoglobulin and mucin domain protein 3 (hTIM-3)
分子名称: Hepatitis A virus cellular receptor 2, SODIUM ION
著者Gao, G.F, Lu, G, Wang, H, Qi, J.
登録日2015-12-07
公開日2016-02-03
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (2.404 Å)
主引用文献Crystal structures of human TIM members: Ebolavirus entry-enhancing receptors
Chin.Sci.Bull., 60, 2015
5F70
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BU of 5f70 by Molmil
Crystal structures of human TIM members
分子名称: Hepatitis A virus cellular receptor 1
著者Gao, G.F, Lu, G, Wang, H, Qi, J.
登録日2015-12-07
公開日2016-02-03
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal structures of human TIM members: Ebolavirus entry-enhancing receptors
Chin.Sci.Bull., 60, 2015
8H3G
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BU of 8h3g by Molmil
Crystal Structure of SARS-CoV-2 Main Protease (Mpro) E166V Mutant in Complex with Inhibitor Enstrelvir
分子名称: 3C-like proteinase nsp5, 6-[(6-chloranyl-2-methyl-indazol-5-yl)amino]-3-[(1-methyl-1,2,4-triazol-3-yl)methyl]-1-[[2,4,5-tris(fluoranyl)phenyl]methyl]-1,3,5-triazine-2,4-dione, GLYCEROL
著者Wang, H, Lin, M, Duan, Y, Zhang, X, Zhou, H, Bian, Q, Liu, X, Rao, Z, Yang, H.
登録日2022-10-08
公開日2023-10-11
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.46 Å)
主引用文献Molecular mechanisms of SARS-CoV-2 resistance to nirmatrelvir.
Nature, 622, 2023
8H3L
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BU of 8h3l by Molmil
Crystal Structure of SARS-CoV-2 Main Protease (Mpro) Double Mutant (T21I and E166V) in Complex with Inhibitor Enstrelvir
分子名称: 3C-like proteinase nsp5, 6-[(6-chloranyl-2-methyl-indazol-5-yl)amino]-3-[(1-methyl-1,2,4-triazol-3-yl)methyl]-1-[[2,4,5-tris(fluoranyl)phenyl]methyl]-1,3,5-triazine-2,4-dione
著者Wang, H, Lin, M, Duan, Y, Zhang, X, Zhou, H, Bian, Q, Liu, X, Rao, Z, Yang, H.
登録日2022-10-08
公開日2023-10-11
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Molecular mechanisms of SARS-CoV-2 resistance to nirmatrelvir.
Nature, 622, 2023
8H3K
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BU of 8h3k by Molmil
Crystal Structure of SARS-CoV-2 Main Protease (Mpro) Double Mutant (L50F and E166V) in Complex with Inhibitor Enstrelvir
分子名称: 3-(4-AMINO-2-METHYL-PYRIMIDIN-5-YLMETHYL)-5-(2-HYDROXY-ETHYL)-4-METHYL-THIAZOL-3-IUM, 3C-like proteinase nsp5, 6-[(6-chloranyl-2-methyl-indazol-5-yl)amino]-3-[(1-methyl-1,2,4-triazol-3-yl)methyl]-1-[[2,4,5-tris(fluoranyl)phenyl]methyl]-1,3,5-triazine-2,4-dione, ...
著者Wang, H, Lin, M, Duan, Y, Zhang, X, Zhou, H, Bian, Q, Liu, X, Rao, Z, Yang, H.
登録日2022-10-08
公開日2023-10-11
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Molecular mechanisms of SARS-CoV-2 resistance to nirmatrelvir.
Nature, 622, 2023
5WH5
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BU of 5wh5 by Molmil
Crystal structure of the PDE4D2 catalytic domain in complex with inhibitor (R)-Zl-n-91
分子名称: 1-[4-(difluoromethoxy)-3-{[(3R)-oxolan-3-yl]oxy}phenyl]-3-methylbutan-1-one, MAGNESIUM ION, ZINC ION, ...
著者Wang, H.
登録日2017-07-14
公開日2018-07-18
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Identification of a PDE4-Specific Pocket for the Design of Selective Inhibitors.
Biochemistry, 57, 2018
5BYB
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BU of 5byb by Molmil
Crystal structure of the catalytic domain of human diphosphoinositol pentakisphosphate kinase 2 (PPIP5K2) in complex with ADP and 1,5-(PA)2-IP4
分子名称: 1,2-ETHANEDIOL, ACETATE ION, ADENOSINE-5'-DIPHOSPHATE, ...
著者Wang, H, Shears, S.B.
登録日2015-06-10
公開日2015-07-22
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Synthetic tools for studying the chemical biology of InsP8.
Chem.Commun.(Camb.), 51, 2015
5DGI
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BU of 5dgi by Molmil
Crystal structure of the catalytic domain of human diphosphoinositol pentakisphosphate kinase 2 (PPIP5K2) in complex with ADP and 3,5-(PCP)2-IP4
分子名称: 1,2-ETHANEDIOL, 3,5-di-methylenebisphosphonate inositol tetrakisphosphate, ACETATE ION, ...
著者Wang, H, Shears, S.B.
登録日2015-08-27
公開日2016-08-10
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Cellular Cations Control Conformational Switching of Inositol Pyrophosphate Analogues.
Chemistry, 22, 2016

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