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8G9B
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BU of 8g9b by Molmil
Human IMPDH2 mutant - L245P, treated with GTP, ATP, IMP, and NAD+; compressed filament segment reconstruction
分子名称: ADENOSINE-5'-TRIPHOSPHATE, GUANOSINE-5'-TRIPHOSPHATE, INOSINIC ACID, ...
著者O'Neill, A.G, Kollman, J.M.
登録日2023-02-21
公開日2023-04-19
最終更新日2023-08-09
実験手法ELECTRON MICROSCOPY (3 Å)
主引用文献Neurodevelopmental disorder mutations in the purine biosynthetic enzyme IMPDH2 disrupt its allosteric regulation.
J.Biol.Chem., 299, 2023
8G8F
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BU of 8g8f by Molmil
Human IMPDH2 mutant - L245P, treated with ATP, IMP, and NAD+; extended filament segment reconstruction
分子名称: ADENOSINE-5'-TRIPHOSPHATE, INOSINIC ACID, Inosine-5'-monophosphate dehydrogenase 2, ...
著者O'Neill, A.G, Kollman, J.M.
登録日2023-02-17
公開日2023-04-19
最終更新日2023-08-09
実験手法ELECTRON MICROSCOPY (2.6 Å)
主引用文献Neurodevelopmental disorder mutations in the purine biosynthetic enzyme IMPDH2 disrupt its allosteric regulation.
J.Biol.Chem., 299, 2023
6CPU
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BU of 6cpu by Molmil
Crystal structure of yeast caPDE2
分子名称: MAGNESIUM ION, Phosphodiesterase, ZINC ION
著者Ke, H, Wang, y.
登録日2018-03-14
公開日2019-02-20
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal Structures of Candida albicans Phosphodiesterase 2 and Implications for Its Biological Functions.
Biochemistry, 57, 2018
5UZT
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BU of 5uzt by Molmil
Structure of wild type pre-miR21 apical loop
分子名称: pre-miR-21
著者Shortridge, M.D, Varani, G.
登録日2017-02-27
公開日2017-05-10
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献A Macrocyclic Peptide Ligand Binds the Oncogenic MicroRNA-21 Precursor and Suppresses Dicer Processing.
ACS Chem. Biol., 12, 2017
5UZZ
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BU of 5uzz by Molmil
Structure of wild type pre-miR21 apical loop
分子名称: 14-mer Peptide, pre-miR21
著者Shortridge, M.D, Varani, G.
登録日2017-02-27
公開日2017-06-14
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献A Macrocyclic Peptide Ligand Binds the Oncogenic MicroRNA-21 Precursor and Suppresses Dicer Processing.
ACS Chem. Biol., 12, 2017
5WXY
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BU of 5wxy by Molmil
Crystal structure of Microcystis aeruginosa PCC 7806 aspartate racemase in complex with L-aspartate
分子名称: ASPARTIC ACID, McyF
著者Cao, D.D, Zhou, K, Jiang, Y.L, Zhou, C.Z.
登録日2017-01-09
公開日2018-01-17
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.63 Å)
主引用文献Structural insights into the catalysis and substrate specificity of cyanobacterial aspartate racemase McyF.
Biochem.Biophys.Res.Commun., 514, 2019
5WXX
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BU of 5wxx by Molmil
Crystal structure of Microcystis aeruginosa PCC 7806 aspartate racemase in complex with citrate
分子名称: CITRIC ACID, McyF
著者Cao, D.D, Zhou, K, Jiang, Y.L, Zhou, C.Z.
登録日2017-01-09
公開日2018-01-17
最終更新日2019-07-31
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Structural insights into the catalysis and substrate specificity of cyanobacterial aspartate racemase McyF.
Biochem.Biophys.Res.Commun., 514, 2019
3KRJ
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BU of 3krj by Molmil
cFMS tyrosine kinase in complex with 4-Cyano-1H-imidazole-2-carboxylic acid (2-cyclohex-1-enyl-4-piperidin-4-yl-phenyl)-amide
分子名称: 4-cyano-N-(2-cyclohex-1-en-1-yl-4-piperidin-4-ylphenyl)-1H-imidazole-2-carboxamide, ACETATE ION, Macrophage colony-stimulating factor 1 receptor, ...
著者Schubert, C.
登録日2009-11-18
公開日2010-12-01
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Optimization of a Potent Class of Arylamide Colony-Stimulating Factor-1 Receptor Inhibitors Leading to Anti-inflammatory Clinical Candidate 4-Cyano-N-[2-(1-cyclohexen-1-yl)-4-[1-[(dimethylamino)acetyl]-4-piperidinyl]phenyl]-1H-imidazole-2-carboxamide (JNJ-28312141).
J.Med.Chem., 54, 2011
5WXZ
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BU of 5wxz by Molmil
Crystal structure of Microcystis aeruginosa PCC 7806 aspartate racemase in complex with D-aspartate
分子名称: D-ASPARTIC ACID, McyF
著者Cao, D.D, Zhou, K, Jiang, Y.L, Zhou, C.Z.
登録日2017-01-09
公開日2018-01-17
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Structural insights into the catalysis and substrate specificity of cyanobacterial aspartate racemase McyF.
Biochem.Biophys.Res.Commun., 514, 2019
5XM8
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BU of 5xm8 by Molmil
Crystal structure of AsfvPolX in complex with DNA enzyme and Pb.
分子名称: DNA (23-mer), DNA (36-MER), LEAD (II) ION, ...
著者Liu, H.H, Gan, J.H.
登録日2017-05-13
公開日2018-01-24
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.55 Å)
主引用文献Crystal structure of an RNA-cleaving DNAzyme.
Nat Commun, 8, 2017
7EOD
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BU of 7eod by Molmil
MITF HLHLZ Delta AKE
分子名称: GLYCEROL, Isoform M1 of Microphthalmia-associated transcription factor
著者Li, P, Liu, Z, Fang, P, Wang, J.
登録日2021-04-22
公開日2022-04-27
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献A unique hyperdynamic dimer interface permits small molecule perturbation of the melanoma oncoprotein MITF for melanoma therapy.
Cell Res., 33, 2023
7F4N
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BU of 7f4n by Molmil
Crystal structure of SAH-bound MTA1-p1-p2 complex
分子名称: MT-a70 family protein, S-ADENOSYL-L-HOMOCYSTEINE, Transmembrane protein, ...
著者Chen, J, Liu, L.
登録日2021-06-21
公開日2022-06-15
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (3.12 Å)
主引用文献Structural basis for MTA1c-mediated DNA N6-adenine methylation
Nat Commun, 13, 2022
7F4R
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BU of 7f4r by Molmil
Crystal structure of MTA1
分子名称: MT-a70 family protein
著者Chen, J, Liu, L.
登録日2021-06-21
公開日2022-06-15
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.83 Å)
主引用文献Structural basis for MTA1c-mediated DNA N6-adenine methylation
Nat Commun, 13, 2022
7F4P
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BU of 7f4p by Molmil
Crystal structure of SAM-bound MTA1-p2 complex
分子名称: MT-a70 family protein, S-ADENOSYLMETHIONINE, Transmembrane protein, ...
著者Chen, J, Liu, L.
登録日2021-06-21
公開日2022-06-15
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.98 Å)
主引用文献Structural basis for MTA1c-mediated DNA N6-adenine methylation
Nat Commun, 13, 2022
7F4S
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BU of 7f4s by Molmil
Crystal structure of TthMTA1-PteMTA9 complex
分子名称: MT-a70 family protein, MTA9
著者Chen, J, Liu, L.
登録日2021-06-21
公開日2022-06-15
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (3.09 Å)
主引用文献Structural basis for MTA1c-mediated DNA N6-adenine methylation
Nat Commun, 13, 2022
7F4O
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BU of 7f4o by Molmil
Crystal structure of MTA1-p2 complex
分子名称: MT-a70 family protein, Transmembrane protein, putative
著者Chen, J, Liu, L.
登録日2021-06-21
公開日2022-06-15
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献Structural basis for MTA1c-mediated DNA N6-adenine methylation
Nat Commun, 13, 2022
7F4Q
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BU of 7f4q by Molmil
Crystal structure of SAH-bound MTA1-p2 complex
分子名称: MT-a70 family protein, S-ADENOSYL-L-HOMOCYSTEINE, Transmembrane protein, ...
著者Chen, J, Liu, L.
登録日2021-06-21
公開日2022-06-15
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (3.42 Å)
主引用文献Structural basis for MTA1c-mediated DNA N6-adenine methylation
Nat Commun, 13, 2022
7F4T
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BU of 7f4t by Molmil
Crystal structure of SAM-bound TthMTA1-Ptep2 complex
分子名称: MT-a70 family protein, Ptep2, S-ADENOSYLMETHIONINE
著者Chen, J, Liu, L.
登録日2021-06-21
公開日2022-06-15
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (3.68 Å)
主引用文献Structural basis for MTA1c-mediated DNA N6-adenine methylation
Nat Commun, 13, 2022
7F4L
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BU of 7f4l by Molmil
Crystal structure of MTA1-p1-p2 complex
分子名称: MT-a70 family protein, Transmembrane protein, putative, ...
著者Chen, J, Liu, L.
登録日2021-06-21
公開日2022-06-15
実験手法X-RAY DIFFRACTION (2.72 Å)
主引用文献Structural basis for MTA1c-mediated DNA N6-adenine methylation
Nat Commun, 13, 2022
7F4M
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BU of 7f4m by Molmil
Crystal structure of SAM-bound MTA1-p1-p2 complex
分子名称: MT-a70 family protein, S-ADENOSYLMETHIONINE, Transmembrane protein, ...
著者Chen, J, Liu, L.
登録日2021-06-21
公開日2022-06-15
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (3.58 Å)
主引用文献Structural basis for MTA1c-mediated DNA N6-adenine methylation
Nat Commun, 13, 2022
3HKS
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BU of 3hks by Molmil
Crystal structure of eukaryotic translation initiation factor eIF-5A2 from Arabidopsis thaliana
分子名称: 1,2-ETHANEDIOL, Eukaryotic translation initiation factor 5A-2
著者Teng, Y.B, He, Y.X, Jiang, Y.L, Chen, Y.X, Zhou, C.Z.
登録日2009-05-25
公開日2009-09-29
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Crystal structure of Arabidopsis translation initiation factor eIF-5A2
Proteins, 77, 2009
6A3N
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BU of 6a3n by Molmil
Crystal structure of the PDE9 catalytic domain in complex with inhibitor 2
分子名称: 1-cyclopentyl-6-({(2R)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxopropan-2-yl}amino)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one, High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A, MAGNESIUM ION, ...
著者Wu, Y.N, Zhou, Q, Chen, Y.P, Luo, H.B.
登録日2018-06-15
公開日2019-04-10
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Discovery of Potent, Selective, and Orally Bioavailable Inhibitors against Phosphodiesterase-9, a Novel Target for the Treatment of Vascular Dementia.
J. Med. Chem., 62, 2019
6O9D
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BU of 6o9d by Molmil
Structure of the IRAK4 kinase domain with compound 5
分子名称: Interleukin-1 receptor-associated kinase 4, N-{7-[4-(aminomethyl)piperidin-1-yl]quinolin-6-yl}pyrazolo[1,5-a]pyrimidine-3-carboxamide
著者Yu, C, Drobnick, J, Bryan, M.C, Kiefer, J, Lupardus, P.J.
登録日2019-03-13
公開日2019-05-22
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.51 Å)
主引用文献Development of Potent and Selective Pyrazolopyrimidine IRAK4 Inhibitors.
J.Med.Chem., 62, 2019
6O8U
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BU of 6o8u by Molmil
Crystal structure of IRAK4 in complex with compound 23
分子名称: GLYCEROL, Interleukin-1 receptor-associated kinase 4, N-[2,2-dimethyl-6-(morpholin-4-yl)-2,3-dihydro-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide, ...
著者Kiefer, J.R, Yu, C, Drobnick, J, Bryan, M.C, Lupardus, P.J.
登録日2019-03-12
公開日2019-05-22
最終更新日2019-07-24
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Development of Potent and Selective Pyrazolopyrimidine IRAK4 Inhibitors.
J.Med.Chem., 62, 2019
6O95
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BU of 6o95 by Molmil
Structure of the IRAK4 kinase domain with compound 41
分子名称: Interleukin-1 receptor-associated kinase 4, N-[(2R)-2-(hydroxymethyl)-2-methyl-6-(morpholin-4-yl)-2,3-dihydro-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide, SULFATE ION
著者Yu, C, Drobnick, J, Bryan, M.C, Kiefer, J, Lupardus, P.J.
登録日2019-03-13
公開日2019-05-22
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (1.77 Å)
主引用文献Development of Potent and Selective Pyrazolopyrimidine IRAK4 Inhibitors.
J.Med.Chem., 62, 2019

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