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8X5D
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BU of 8x5d by Molmil
The cryo-EM structure of the Mycobacterium tuberculosis CRISPR-Csm complex
分子名称: CRISPR system Cms endoribonuclease Csm3, CRISPR system Cms protein Csm5, Csm2, ...
著者Liu, M.X, Li, Z.K.
登録日2023-11-17
公開日2024-03-06
最終更新日2024-07-31
実験手法ELECTRON MICROSCOPY (3.1 Å)
主引用文献Type-III-A structure of mycobacteria CRISPR-Csm complexes involving atypical crRNAs.
Int.J.Biol.Macromol., 260, 2024
5ZUG
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BU of 5zug by Molmil
Structure of the bacterial acetate channel SatP
分子名称: Succinate-acetate/proton symporter SatP, nonyl beta-D-glucopyranoside
著者Sun, P.C, Li, J.L, Xiao, Q.J, Guan, Z.Y, Deng, D.
登録日2018-05-07
公開日2018-11-21
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (2.802 Å)
主引用文献Crystal structure of the bacterial acetate transporter SatP reveals that it forms a hexameric channel.
J. Biol. Chem., 293, 2018
4QXE
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BU of 4qxe by Molmil
Crystal structure of LGR4 fused with hagfish VLR
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, GLYCEROL, ...
著者Xu, J.G, Huang, C, Zhu, Y.
登録日2014-07-20
公開日2014-10-22
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Crystal structure of LGR4 fused with hagfish VLR
TO BE PUBLISHED
6BE0
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BU of 6be0 by Molmil
AvrA delL154 with IP6, CoA
分子名称: AvrA, COENZYME A, INOSITOL HEXAKISPHOSPHATE
著者Labriola, J.M, Nagar, B.
登録日2017-10-24
公開日2018-08-01
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.438 Å)
主引用文献Structural Analysis of the Bacterial Effector AvrA Identifies a Critical Helix Involved in Substrate Recognition.
Biochemistry, 57, 2018
6BVU
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BU of 6bvu by Molmil
SFTI-HFRW-1
分子名称: Trypsin inhibitor 1 HFRW-1
著者Schroeder, C.I.
登録日2017-12-13
公開日2018-12-19
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Development of Novel Melanocortin Receptor Agonists Based on the Cyclic Peptide Framework of Sunflower Trypsin Inhibitor-1.
J.Med.Chem., 61, 2018
6LN1
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BU of 6ln1 by Molmil
A natural inhibitor of DYRK1A for treatment of diabetes mellitus
分子名称: 1,3,5,8-tetrakis(oxidanyl)xanthen-9-one, Dual specificity tyrosine-phosphorylation-regulated kinase 1A
著者Li, H, Chen, L.X, Zheng, M.Z, Zhang, Q.Z, Zhang, C.L, Wu, C.R, Yang, K.Y, Song, Z.R, Wang, Q.Q, Li, C, Zhou, Y.R, Chen, J.C.
登録日2019-12-28
公開日2021-10-06
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.699 Å)
主引用文献A natural DYRK1A inhibitor as a potential stimulator for beta-cell proliferation in diabetes.
Clin Transl Med, 11, 2021
5Z1C
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BU of 5z1c by Molmil
The crystal structure of uPA in complex with 4-Iodobenzylamine at pH7.4
分子名称: 1-(4-iodophenyl)methanamine, Urokinase-type plasminogen activator
著者Jiang, L.G, Zhang, X, Luo, Z.P, Huang, M.D.
登録日2017-12-25
公開日2018-12-26
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献Halogen bonding for the design of inhibitors by targeting the S1 pocket of serine proteases
Rsc Adv, 49, 2018
6MT0
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BU of 6mt0 by Molmil
Crystal structure of human Pim-1 kinase in complex with a quinazolinone-pyrrolodihydropyrrolone inhibitor
分子名称: 3-(1-methylcyclopropyl)-2-[(1-methylcyclopropyl)amino]-8-[(6R)-6-methyl-4-oxo-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrol-2-yl]quinazolin-4(3H)-one, GLYCEROL, Serine/threonine-protein kinase pim-1
著者Mohr, C.
登録日2018-10-18
公開日2019-01-16
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Discovery of ( R)-8-(6-Methyl-4-oxo-1,4,5,6-tetrahydropyrrolo[3,4- b]pyrrol-2-yl)-3-(1-methylcyclopropyl)-2-((1-methylcyclopropyl)amino)quinazolin-4(3 H)-one, a Potent and Selective Pim-1/2 Kinase Inhibitor for Hematological Malignancies.
J. Med. Chem., 62, 2019
6BVW
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BU of 6bvw by Molmil
SFTI-HFRW-3
分子名称: Trypsin inhibitor 1 HFRW-3
著者Schroeder, C.I.
登録日2017-12-14
公開日2018-12-19
最終更新日2023-11-15
実験手法SOLUTION NMR
主引用文献Development of Novel Melanocortin Receptor Agonists Based on the Cyclic Peptide Framework of Sunflower Trypsin Inhibitor-1.
J.Med.Chem., 61, 2018
6BVX
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BU of 6bvx by Molmil
SFTI-HFRW-2
分子名称: Trypsin inhibitor 1 HFRW-2
著者Schroeder, C.I.
登録日2017-12-14
公開日2018-12-19
最終更新日2023-11-15
実験手法SOLUTION NMR
主引用文献Development of Novel Melanocortin Receptor Agonists Based on the Cyclic Peptide Framework of Sunflower Trypsin Inhibitor-1.
J.Med.Chem., 61, 2018
6BVY
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BU of 6bvy by Molmil
SFTI-HFRW-4
分子名称: Trypsin inhibitor 1 HFRW-4
著者Schroeder, C.I, White, A.
登録日2017-12-14
公開日2018-04-18
最終更新日2023-11-15
実験手法SOLUTION NMR
主引用文献Development of Novel Melanocortin Receptor Agonists Based on the Cyclic Peptide Framework of Sunflower Trypsin Inhibitor-1.
J. Med. Chem., 61, 2018
6K2Z
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BU of 6k2z by Molmil
Human Galectin-14 with lactose
分子名称: Placental protein 13-like, beta-D-galactopyranose-(1-4)-alpha-D-glucopyranose, beta-D-galactopyranose-(1-4)-beta-D-glucopyranose
著者Su, J.
登録日2019-05-15
公開日2020-06-17
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structure-function studies of galectin-14, an important effector molecule in embryology.
Febs J., 288, 2021
6KW1
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BU of 6kw1 by Molmil
The structure of the metallo-beta-lactamase VIM-2 in complex with a triazolylthioacetamide 1b
分子名称: 2-[3-[2-(1H-benzimidazol-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-1H-1,2,4-triazol-5-yl]benzoic acid, ACETATE ION, Beta-lactamase class B VIM-2, ...
著者Yang, K.W, Xiang, Y.
登録日2019-09-05
公開日2020-09-09
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.775212 Å)
主引用文献Kinetic, Thermodynamic, and Crystallographic Studies of 2-Triazolylthioacetamides as Verona Integron-Encoded Metallo-beta-Lactamase 2 (VIM-2) Inhibitor.
Biomolecules, 10, 2020
6LJP
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BU of 6ljp by Molmil
Crystal structure of human galectin-16
分子名称: Galectin-16
著者Su, J.
登録日2019-12-17
公開日2020-10-14
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Human galectin-16 has a pseudo ligand binding site and plays a role in regulating c-Rel-mediated lymphocyte activity.
Biochim Biophys Acta Gen Subj, 1865, 2020
6LJQ
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BU of 6ljq by Molmil
human galectin-16 R55N
分子名称: Galectin-16, beta-D-galactopyranose-(1-4)-beta-D-glucopyranose
著者Su, J.
登録日2019-12-17
公開日2020-10-14
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.49 Å)
主引用文献Human galectin-16 has a pseudo ligand binding site and plays a role in regulating c-Rel-mediated lymphocyte activity.
Biochim Biophys Acta Gen Subj, 1865, 2020
6LJR
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BU of 6ljr by Molmil
human galectin-16 R55N/H57R
分子名称: Galectin-16, beta-D-galactopyranose-(1-4)-beta-D-glucopyranose
著者Su, J.
登録日2019-12-17
公開日2020-10-14
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Human galectin-16 has a pseudo ligand binding site and plays a role in regulating c-Rel-mediated lymphocyte activity.
Biochim Biophys Acta Gen Subj, 1865, 2020
6K2Y
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BU of 6k2y by Molmil
Human Galectin-14
分子名称: Placental protein 13-like
著者Su, J.
登録日2019-05-15
公開日2020-06-17
最終更新日2021-03-10
実験手法X-RAY DIFFRACTION (1.57 Å)
主引用文献Structure-function studies of galectin-14, an important effector molecule in embryology.
Febs J., 288, 2021
5EWS
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BU of 5ews by Molmil
Sugar binding protein - human galectin-2
分子名称: Galectin-2, beta-D-galactopyranose-(1-4)-beta-D-glucopyranose
著者Su, J.Y, Si, Y.L.
登録日2015-11-21
公開日2016-09-14
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Human galectin-2 interacts with carbohydrates and peptides non-classically: new insight from X-ray crystallography and hemagglutination.
Acta Biochim. Biophys. Sin. (Shanghai), 48, 2016
6OBD
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BU of 6obd by Molmil
Crystal structure of anti-GLD52 Fab complex with human GLD52 peptide mimetic
分子名称: GLD52 peptide mimetic, PHOSPHORIC ACID MONO-(2-AMINO-ETHYL) ESTER, ZINC ION, ...
著者Wei, R.
登録日2019-03-20
公開日2019-07-03
最終更新日2019-09-25
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Engineering an anti-CD52 antibody for enhanced deamidation stability.
Mabs, 11, 2019
6LBP
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BU of 6lbp by Molmil
Structure of the Glutamine Phosphoribosylpyrophosphate Amidotransferase from Arabidopsis thaliana
分子名称: Amidophosphoribosyltransferase 2, chloroplastic, IRON/SULFUR CLUSTER
著者Yi, Z, Cao, X, Han, F, Feng, Y.
登録日2019-11-14
公開日2020-04-29
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (3.065 Å)
主引用文献Crystal Structure of the Chloroplastic Glutamine Phosphoribosylpyrophosphate Amidotransferase GPRAT2 FromArabidopsis thaliana.
Front Plant Sci, 11, 2020
4RPV
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BU of 4rpv by Molmil
co-crystal structure of Pim1 with compound 3
分子名称: (3S)-1-{6-[5-(2,6-difluorophenyl)-2H-indazol-3-yl]pyrazin-2-yl}piperidin-3-amine, Serine/threonine-protein kinase pim-1
著者Huang, X.
登録日2014-10-31
公開日2015-02-04
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (3.05 Å)
主引用文献The discovery of novel 3-(pyrazin-2-yl)-1H-indazoles as potent pan-Pim kinase inhibitors.
Bioorg.Med.Chem.Lett., 25, 2015
5IPJ
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BU of 5ipj by Molmil
Crystal structure of human Pim-1 kinase in complex with a quinazolinone-pyrrolopyrrolone inhibitor.
分子名称: 2-(tert-butylamino)-3-methyl-8-[(6R)-6-methyl-4-oxo-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrol-2-yl]quinazolin-4(3H)-one, GLYCEROL, Serine/threonine-protein kinase pim-1
著者Mohr, C.
登録日2016-03-09
公開日2016-06-22
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Discovery and Optimization of Quinazolinone-pyrrolopyrrolones as Potent and Orally Bioavailable Pan-Pim Kinase Inhibitors.
J.Med.Chem., 59, 2016
5GQT
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BU of 5gqt by Molmil
Crystal structure of a specifier Protein from Arabidopsis thaliana
分子名称: Nitrile-specifier protein 1
著者Zhang, W, Feng, Y.
登録日2016-08-08
公開日2017-06-21
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (3.022 Å)
主引用文献Crystal structure of the nitrile-specifier protein NSP1 from Arabidopsis thaliana
Biochem. Biophys. Res. Commun., 488, 2017
5YLF
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BU of 5ylf by Molmil
MCR-1 complex with D-glucose
分子名称: Probable phosphatidylethanolamine transferase Mcr-1, ZINC ION, beta-D-glucopyranose
著者Wei, P.C, Song, G.J, Shi, M.Y, Zhou, Y.F, Liu, Y, Lei, J, Chen, P, Yin, L.
登録日2017-10-17
公開日2017-11-08
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Substrate analog interaction with MCR-1 offers insight into the rising threat of the plasmid-mediated transferable colistin resistance.
FASEB J., 32, 2018
5YLC
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BU of 5ylc by Molmil
Crystal Structure of MCR-1 Catalytic Domain
分子名称: Probable phosphatidylethanolamine transferase Mcr-1, ZINC ION
著者Wei, P.C, Song, G.J, Shi, M.Y, Zhou, Y.F, Liu, Y, Lei, J, Chen, P, Yin, L.
登録日2017-10-17
公開日2017-11-08
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Substrate analog interaction with MCR-1 offers insight into the rising threat of the plasmid-mediated transferable colistin resistance.
FASEB J., 32, 2018

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