PDB: 37224 件ウェブページステータス検索Chemie searchBIRD

---

8U7W	Crystal structure of non-receptor protein tyrosine phosphatase SHP2 in complex with inhibitor compound 7 分子名称: 1-{6-[(2,3-dichlorophenyl)sulfanyl]pyrido[2,3-b]pyrazin-2-yl}-4-methylpiperidin-4-amine, Tyrosine-protein phosphatase non-receptor type 11 著者 Mou, T.C. 登録日 2023-09-15 公開日 2024-01-03 実験手法 X-RAY DIFFRACTION (2.05 Å) 主引用文献 Discovery of 5-Azaquinoxaline Derivatives as Potent and Orally Bioavailable Allosteric SHP2 Inhibitors. Acs Med.Chem.Lett., 14, 2023
8U7H	Cryo-EM structure of LRRK2 bound to type I inhibitor GNE-7915 分子名称: GUANOSINE-5'-DIPHOSPHATE, [4-[[4-(ethylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-2-fluoranyl-5-methoxy-phenyl]-morpholin-4-yl-methanone, non-specific serine/threonine protein kinase 著者 Zhu, H, Sun, J. 登録日 2023-09-15 公開日 2024-01-31 実験手法 ELECTRON MICROSCOPY (3.8 Å) 主引用文献 Pharmacology of LRRK2 with type I and II kinase inhibitors revealed by cryo-EM. Cell Discov, 10, 2024
8U7L	Cryo-EM structure of LRRK2 bound to type II inhibitor GZD824 分子名称: 4-methyl-N-{4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl}-3-[(1H-pyrazolo[3,4-b]pyridin-5-yl)ethynyl]benzamide, GUANOSINE-5'-DIPHOSPHATE, Leucine-rich repeat serine/threonine-protein kinase 2 著者 Zhu, H, Sun, J. 登録日 2023-09-15 公開日 2024-01-31 実験手法 ELECTRON MICROSCOPY (3.6 Å) 主引用文献 Pharmacology of LRRK2 with type I and II kinase inhibitors revealed by cryo-EM. Cell Discov, 10, 2024
8QKI	Connexin-32 hemichannel upon addition of mefloquine 分子名称: CHOLESTEROL, Gap junction beta-1 protein 著者 Lavriha, P, Korkhov, V.M, Han, Y. 登録日 2023-09-15 公開日 2024-09-25 実験手法 ELECTRON MICROSCOPY (3.46 Å) 主引用文献 Two distinct mechanisms of connexin channel inhibition by mefloquine and 2-aminoethoxydiphenyl borate To Be Published
8WDI	Crystal structure of lysozyme by fixed-target pink-beam serial synchrotron crystallography 分子名称: CHLORIDE ION, Lysozyme C 著者 Nam, K.H. 登録日 2023-09-15 公開日 2023-10-04 最終更新日 2024-04-17 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Fixed-Target Pink-Beam Serial Synchrotron Crystallography at Pohang Light Source II. Crystals, 13, 2023
8WDK	The complex structure of Cul2-VCB-Protac-Wee1 分子名称: (2S,4R)-1-[(2S)-3,3-dimethyl-2-[3-[4-[4-[4-[[3-oxidanylidene-1-[6-(2-oxidanylpropan-2-yl)pyridin-2-yl]-2-prop-2-enyl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]phenyl]piperazin-1-yl]butoxy]propanoylamino]butanoyl]-N-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide, Cullin-2, E3 ubiquitin-protein ligase RBX1, ... 著者 Wang, P, Zhang, T.T. 登録日 2023-09-15 公開日 2024-09-18 実験手法 ELECTRON MICROSCOPY (3.64 Å) 主引用文献 Structure of Cul2-VCB-Protac-Wee1 complex at 3.6 Angstrom resolution. To Be Published
8QKE	PvSub1 Catalytic Domain in Complex with Peptidomimetic Inhibitor (MH-13) 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, Peptidomimetic Inhibitor (MH-13), ... 著者 Batista, F.A, Martinez, M, Bouillon, A, Mechaly, A, Alzari, P.M, Haouz, A, Barale, J.C. 登録日 2023-09-15 公開日 2024-03-20 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (1.504 Å) 主引用文献 Insights from structure-activity relationships and the binding mode of peptidic alpha-ketoamide inhibitors of the malaria drug target subtilisin-like SUB1. Eur.J.Med.Chem., 269, 2024
8QKG	PvSub1 Catalytic Domain in Complex with Peptidomimetic Inhibitor (MAM-125) 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, Peptidomimetic Inhibitor (MAM-125), ... 著者 Batista, F.A, Martinez, M, Bouillon, A, Mechaly, A, Alzari, P.M, Haouz, A, Barale, J.C. 登録日 2023-09-15 公開日 2024-03-20 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (1.538 Å) 主引用文献 Insights from structure-activity relationships and the binding mode of peptidic alpha-ketoamide inhibitors of the malaria drug target subtilisin-like SUB1. Eur.J.Med.Chem., 269, 2024
8QKJ	PvSub1 Catalytic Domain in Complex with Peptidomimetic Inhibitor (MAM-133) 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, Peptidomimetic Inhibitor (MAM-133), ... 著者 Batista, F.A, Martinez, M, Bouillon, A, Mechaly, A, Alzari, P.M, Haouz, A, Barale, J.C. 登録日 2023-09-15 公開日 2024-03-20 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (1.767 Å) 主引用文献 Insights from structure-activity relationships and the binding mode of peptidic alpha-ketoamide inhibitors of the malaria drug target subtilisin-like SUB1. Eur.J.Med.Chem., 269, 2024
8QK3	Human Adenovirus type 11 fiber knob in complex with its cell receptors, Desmoglein-2 and CD46 分子名称: Desmoglein-2, Fiber protein, Membrane cofactor protein 著者 Effantin, G. 登録日 2023-09-14 公開日 2023-11-01 最終更新日 2023-12-13 実験手法 ELECTRON MICROSCOPY (3.2 Å) 主引用文献 Toward the understanding of DSG2 and CD46 interaction with HAdV-11 fiber, a super-complex analysis. J.Virol., 97, 2023
8QJX	Human Adenovirus type 11 fiber knob in complex with two copies of its cell receptor, Desmoglein-2 分子名称: Desmoglein-2, Fiber protein 著者 Effantin, G. 登録日 2023-09-14 公開日 2023-11-01 最終更新日 2023-12-13 実験手法 ELECTRON MICROSCOPY (3.3 Å) 主引用文献 Toward the understanding of DSG2 and CD46 interaction with HAdV-11 fiber, a super-complex analysis. J.Virol., 97, 2023
8QJY	Human Adenovirus type 11 fiber knob in complex with two copies of its cell receptor, Desmoglein-2 分子名称: Desmoglein-2, Fiber protein 著者 Effantin, G. 登録日 2023-09-14 公開日 2023-11-01 最終更新日 2023-12-13 実験手法 ELECTRON MICROSCOPY (3.5 Å) 主引用文献 Toward the understanding of DSG2 and CD46 interaction with HAdV-11 fiber, a super-complex analysis. J.Virol., 97, 2023
8QK6	Connexin-32 hemichannel upon addition of 2-aminoetoxydiphenyl borate 分子名称: CHOLESTEROL, Gap junction beta-1 protein 著者 Lavriha, P, Korkhov, V.M, Han, Y. 登録日 2023-09-14 公開日 2024-09-25 実験手法 ELECTRON MICROSCOPY (3.18 Å) 主引用文献 Two distinct mechanisms of connexin channel inhibition by mefloquine and 2-aminoethoxydiphenyl borate To Be Published
8WD6	Cryo-EM structure of the ABCG25 分子名称: ABC transporter G family member 25 著者 Xin, J, Yan, K.G. 登録日 2023-09-14 公開日 2023-09-27 最終更新日 2024-04-10 実験手法 ELECTRON MICROSCOPY (2.87 Å) 主引用文献 Structural insights into AtABCG25, an angiosperm-specific abscisic acid exporter. Plant Commun., 5, 2024
8WD0	Crystal structure of T2R-TTL-Erianin complex 分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)ethyl]phenol, CALCIUM ION, ... 著者 Yang, J. 登録日 2023-09-14 公開日 2024-07-03 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 The cytotoxic natural compound erianin binds to colchicine site of beta-tubulin and overcomes taxane resistance Bioorg.Chem., 150, 2024
8WD9	Cryo-EM structure of Mycobacterium tuberculosis DppABCD in apo form 分子名称: (2S)-1-(hexadecanoyloxy)propan-2-yl (10S)-10-methyloctadecanoate, PALMITIC ACID, Probable dipeptide-transport ATP-binding protein ABC transporter DppD, ... 著者 Hu, T, Zhang, B, Rao, Z. 登録日 2023-09-14 公開日 2024-09-18 実験手法 ELECTRON MICROSCOPY (3.35 Å) 主引用文献 Cryo-EM structure of Mycobacterium tuberculosis DppABCD in apo form To Be Published
8WDB	Cryo-EM structure of the ATP-bound DppABCD complex 分子名称: ADENOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, Probable dipeptide-transport ATP-binding protein ABC transporter DppD, ... 著者 Hu, T, Zhang, B, Rao, Z. 登録日 2023-09-14 公開日 2024-09-18 実験手法 ELECTRON MICROSCOPY (2.86 Å) 主引用文献 Cryo-EM structure of the ATP-bound DppABCD complex To Be Published
8WDA	Cryo-EM structure of the substrate-bound DppABCD complex 分子名称: (2S)-1-(hexadecanoyloxy)propan-2-yl (10S)-10-methyloctadecanoate, PALMITIC ACID, Probable dipeptide-transport ATP-binding protein ABC transporter DppD, ... 著者 Hu, T, Zhang, B, Rao, Z. 登録日 2023-09-14 公開日 2024-09-18 実験手法 ELECTRON MICROSCOPY (3.26 Å) 主引用文献 Cryo-EM structure of the substrate-bound DppABCD complex To Be Published
8QJI	Crystal structure of GSK3b in complex with N-(4-(5-(1,2,4-oxadiazol-3-yl)thiophen-2-yl)pyridin-2-yl)cyclopropanecarboxamide inhibitor (TW362) 分子名称: Glycogen synthase kinase-3 beta, N-[4-[5-(1,2,4-oxadiazol-3-yl)thiophen-2-yl]pyridin-2-yl]cyclopropanecarboxamide 著者 Slugocka, E.A, Grygier, P, Wichur, T, Czarna, A, Wieckowska, A. 登録日 2023-09-13 公開日 2024-09-04 最終更新日 2024-09-11 実験手法 X-RAY DIFFRACTION (3.02 Å) 主引用文献 Exploring Novel GSK-3 beta Inhibitors for Anti-Neuroinflammatory and Neuroprotective Effects: Synthesis, Crystallography, Computational Analysis, and Biological Evaluation. Acs Chem Neurosci, 15, 2024
8QJF	Connexin-32 gap junction channel in complex with 2-aminoethoxydiphenyl borate 分子名称: CHOLESTEROL, Gap junction beta-1 protein 著者 Lavriha, P, Korkhov, V.M, Han, Y. 登録日 2023-09-13 公開日 2024-09-25 実験手法 ELECTRON MICROSCOPY (2.86 Å) 主引用文献 Two distinct mechanisms of connexin channel inhibition by mefloquine and 2-aminoethoxydiphenyl borate To Be Published
8QJH	Connexin-32 gap junction channel in complex with mefloquine 分子名称: Gap junction beta-1 protein 著者 Lavriha, P, Korkhov, V.M, Han, Y. 登録日 2023-09-13 公開日 2024-09-25 実験手法 ELECTRON MICROSCOPY (2.91 Å) 主引用文献 Two distinct mechanisms of connexin channel inhibition by mefloquine and 2-aminoethoxydiphenyl borate To Be Published
8U6G	Crystal Structure of HIV-1 Reverse Transcriptase in Complex with 3-(2-(2-(3-acryloyl-2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)ethoxy)-4-chlorophenoxy)-5-chlorobenzonitrile (JLJ744), a non-nucleoside inhibitor 分子名称: 3-chloro-5-{4-chloro-2-[2-(2-oxo-3-propanoyl-2,3-dihydro-1H-benzimidazol-1-yl)ethoxy]phenoxy}benzonitrile, MAGNESIUM ION, Reverse transcriptase/ribonuclease H, ... 著者 Prucha, G, Carter, Z, Jorgensen, W.L, Anderson, K.S. 登録日 2023-09-13 公開日 2023-11-08 実験手法 X-RAY DIFFRACTION (2.77 Å) 主引用文献 Covalent and noncovalent strategies for targeting Lys102 in HIV-1 reverse transcriptase. Eur.J.Med.Chem., 262, 2023
8U6B	Crystal Structure of HIV-1 Reverse Transcriptase in Complex with N-(4-chloro-3-(3-chloro-5-cyanophenoxy)phenethyl)acrylamide (JLJ731), a non-nucleoside inhibitor 分子名称: N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenyl]ethyl}prop-2-enamide, Reverse transcriptase/ribonuclease H, p51 RT 著者 Hollander, K, Henry, S, Jorgensen, W.L, Anderson, K.S. 登録日 2023-09-13 公開日 2023-11-08 実験手法 X-RAY DIFFRACTION (2.35 Å) 主引用文献 Covalent and noncovalent strategies for targeting Lys102 in HIV-1 reverse transcriptase. Eur.J.Med.Chem., 262, 2023
8U6P	Crystal Structure of HIV-1 Reverse Transcriptase in Complex with 3-(2-((2-cyanoindolizin-8-yl)oxy)phenoxy)-N,N-dimethylpropanamide (JLJ754), a non-nucleoside inhibitor 分子名称: 3-(2-{[(4S)-2-cyanoindolizin-8-yl]oxy}phenoxy)-N,N-dimethylpropanamide, MAGNESIUM ION, PHOSPHATE ION, ... 著者 Prucha, G, Henry, S, Jorgensen, W.L, Anderson, K.S. 登録日 2023-09-13 公開日 2023-11-08 実験手法 X-RAY DIFFRACTION (2.81 Å) 主引用文献 Covalent and noncovalent strategies for targeting Lys102 in HIV-1 reverse transcriptase. Eur.J.Med.Chem., 262, 2023
8U6A	Crystal Structure of HIV-1 Reverse Transcriptase in Complex with (JLJ729), a non-nucleoside inhibitor 分子名称: N-(3-{2-[5-chloro-2-(3-chloro-5-cyanophenoxy)phenoxy]ethyl}phenyl)prop-2-enamide, Reverse transcriptase/ribonuclease H, p51 RT 著者 Hollander, K, Carter, Z, Jorgensen, W.L, Anderson, K.S. 登録日 2023-09-13 公開日 2023-11-08 実験手法 X-RAY DIFFRACTION (2.37 Å) 主引用文献 Covalent and noncovalent strategies for targeting Lys102 in HIV-1 reverse transcriptase. Eur.J.Med.Chem., 262, 2023

<35363738394041424344454647484950>